CandActCFTR Seed Compounds


The following 3114 structures with currently 268914 synonyms are a list compounds which have been reported in 111 CFTR related publications published in the past decade. We collected all structures regardless of an activation of CFTR function or an improvement of CFTR processing, thus also including reported negative compound references or even inhibitors.



ID: 2001

chemical graph of compound 2001



InChIKey: RRCYPDDIDYVEIW-UHFFFAOYSA-N
SMILES: COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6710639
synonyms found at PubChem are:
RETUSIN 7-METHYL ETHER, KBio2_006097, Spectrum_000481, AC1O8JTF, Spectrum2_000055, Spectrum3_001266, Spectrum4_001287, Spectrum5_000013, BSPBio_002832, KBioGR_001633, KBioSS_000961, SPECTRUM240645, SPBio_000209, CHEMBL1290347, KBio2_000961, KBio2_003529, KBio3_002332, RRCYPDDIDYVEIW-UHFFFAOYSA-N, CCG-38359, SDCCGMLS-0066500.P001, NCGC00095551-01, NCGC00095551-02, NCGC00178446-01, SR-05000002550, SR-05000002550-1, 8-hydroxy-7-methoxy-3-(4-methoxyphenyl)chromen-4-one, BRD-K59294488-001-02-1, 15607-89-3


ID: 2002

chemical graph of compound 2002



InChIKey: RRGUKTPIGVIEKM-UHFFFAOYSA-N
SMILES: C1CCC(CC1)N2C(=NN=N2)CCCCOC3=CC4=C(C=C3)NC(=O)CC4

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2754
synonyms found at PubChem are:
cilostazol, 73963-72-1, Pletal, Cilostazole, Pletaal, Cilostazolum, OPC-13013, Cilostazolum [INN-Latin], OPC 13013, OPC 21, OPC-21, Cilostazol [INN:JAN], Pletal (TN), UNII-N7Z035406B, C20H27N5O2, 6-(4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxy)-3,4-dihydro-2(1H)-quinolinone, BRN 3632107, 6-[4-(1-cyclohexyltetrazol-5-yl)butoxy]-3,4-dihydro-1H-quinolin-2-one, 3,4-Dihydro-6-(4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy)-2(1H)-quinolinone, 6-(4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy)-3,4-dihydroquinolin-2(1H)-one, MLS000028470, CHEBI:31401, 6-(4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxy)-3,4-dihydrocarbostyril, N7Z035406B, NCGC00015207-07, SMR000058428, 6-[4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxy]-3,4-dihydro-2(1H)-quinolinone, 6-[4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy]-3,4-dihydroquinolin-2(1H)-one, C 0737, DSSTox_CID_25132, DSSTox_RID_80693, DSSTox_GSID_45132, Q-200854, 6-(4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxyl)-3,4-dihydrocarobostyril, 2(1H)-Quinolinone, 3,4-dihydro-6-(4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy)-, 2(1H)-Quionlinone, 6-(4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy)-3,4-dihydro-, 6-[4-(1-cyclohexyl-1H-1,2,3,4-tetrazol-5-yl)butoxy]-1,2,3,4-tetrahydroquinolin-2-one, 6-[4-(1-Cyclohexyl-1H-tetrazol-5-yl)-butoxy]-3,4-dihydro-2(1H)-quinolinone, CPD000058428, CAS-73963-72-1, SR-01000003107, Cilostazol,(S), Pletal, Cilostazol, CILASTAZOL, RETAL, Pleta (TN), Cilostazol [USAN:USP:INN:BAN:JAN], Tocris-1692, Opera_ID_488, Spectrum2_001118, Spectrum3_001170, Spectrum4_000772, Spectrum5_001762, Lopac-C-0737, Otsuka brand of cilostazol, CHEMBL799, D03VPC, D0E7MJ, AC1L1EE2, Lopac0_000218, REGID_for_CID_2754, SCHEMBL16128, BSPBio_002759, KBioGR_001184, MLS000758281, MLS000759507, MLS001076067, MLS002153891, SPECTRUM1505230, SPBio_001256, GTPL7148, Cilostazol (JP15/USAN/INN), Cilostazol (JP17/USAN/INN), DTXSID9045132, CTK8F0315, HSDB 8312, KBio3_002259, MolPort-001-758-007, RRGUKTPIGVIEKM-UHFFFAOYSA-N, ZX-AFC000447, BCPP000279, HMS1922N15, HMS2093M14, HMS2096F16, HMS2234C06, HMS3260L17, HMS3268O09, HMS3654J13, HMS3713F16, Pharmakon1600-01505230, ACT02663, BCP03724, ZINC1552174, ZX-AT018851, Tox21_110098, Tox21_500218, BI7396, BS0279, CCG-39646, KM1582, MFCD00866780, NSC758936, s1294, AKOS015855512, Cilostazol, >=98% (HPLC), powder, OPC 13013; OPC 21; Pletaal, Tox21_110098_1, AC-4334, AM90304, API0002016, BCP9000530, CL23867, CS-1759, DB01166, KS-5154, LP00218, MCULE-8893820969, NSC-758936, OR13681, RP18108, NCGC00015207-01, NCGC00015207-02, NCGC00015207-03, NCGC00015207-04, NCGC00015207-05, NCGC00015207-06, NCGC00015207-08, NCGC00015207-09, NCGC00015207-10, NCGC00015207-11, NCGC00015207-12, NCGC00022153-02, NCGC00022153-04, NCGC00022153-05, NCGC00022153-06, NCGC00022153-07, NCGC00260903-01, AJ-26894, AN-12078, CC-25783, CJ-24365, HY-17464, SAM001246734, SAM001247085, SC-14107, BCP0726000145, SBI-0050206.P002, AB0012441, AB2000035, LS-142693, TC-063580, TL8005113, EU-0100218, FT-0602474, FT-0645036, ST24046323, D01896, J90029, AB00382988-14, AB00382988_15, AB00382988_16, 963C721, A837982, C-21103, SR-01000003107-2, SR-01000003107-4, SR-01000003107-7, BRD-K67017579-001-04-2, BRD-K67017579-001-05-9, BRD-K67017579-001-07-5, BRD-K67017579-001-13-3, BRD-K67017579-001-17-4, SR-01000003107-10, Cilastatin sodium, Antibiotic for Culture Media Use Only, Cilostazol, United States Pharmacopeia (USP) Reference Standard, 6-[4-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)butoxy]-3,4-dihydrocarbostyril, 6-[4-(1-cyclohexyl-5-tetrazolyl)butoxy]-3,4-dihydro-1H-quinolin-2-one, 6-[4-(l-cyclohexyl-1,2,3,4-tetrazol-5-yl)butoxyl]-3,4-dihydrocarbostyril, Cilostazol, Pharmaceutical Secondary Standard; Certified Reference Material, 2(1H)-Quinolinone, 6-[4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy]-3,4-dihydro-, 6-[4-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)butoxy]-3,4-dihydro-1H-quinolin-2-one, 6-[4-(1-Cyclohexyl-1H-tetrazol-5-yl)-butoxy]-3,4-dihydro-1H-quinolin-2-one, 6-[4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxy]-2-oxo-1,2,3,4-tetrahydroquinoline


ID: 2003

chemical graph of compound 2003



InChIKey: RRIXMDDCPQUWIO-UHFFFAOYSA-N
SMILES: C(C1=C(C)C=CS1)1C(C(=O)OCC=C)=C(C)NC(C)=C1C(=O)OCC=C

biological descriptors:

CFTR relevance: CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"N Pedemonte" "MT Mazzei" "M Zacchigna" "M Giampieri" "LJ Galietta" "P Fossa" "M Mazzei" "F Cateni"


CID is 10833168
synonyms found at PubChem are:
CHEMBL593638, 2,6-Dimethyl-4-(3-methyl-2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diallyl ester


ID: 2004

chemical graph of compound 2004



InChIKey: RRJFVPUCXDGFJB-UHFFFAOYSA-N
SMILES: CC(C)(C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O)C(=O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 63002
synonyms found at PubChem are:
FEXOFENADINE HYDROCHLORIDE, 153439-40-8, FEXOFENADINE HCL, Allegra, Telfast, 2-(4-(1-Hydroxy-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butyl)phenyl)-2-methylpropanoic acid hydrochloride, Fexofenidine hydrochloride, MDL 16,455A, 138452-21-8, Fexofenadine (hydrochloride), Terfenadine carboxylate hydrochloride, MDL 16455 hydrochloride, MDL-16455A, Terfenidine carboxylate hydrochloride, Allegra (TN), MDL-16455, C32H40ClNO4, DSSTox_CID_28642, DSSTox_RID_82912, DSSTox_GSID_48716, 2-(4-{1-hydroxy-4-[4-(hydroxydiphenylmethyl)piperidin-1-yl]butyl}phenyl)-2-methylpropanoic acid hydrochloride, Allegra Allergy, Allegra Hives, SMR000718798, CAS-153439-40-8, MFCD00865710, NCGC00015453-05, Children's Allegra Hives, Children's Allegra Allergy, Altiva, UNII-2S068B75ZU, Carboxyterfenadine hydrochloride, Allegra Flash, SR-01000075889, Allegra OD, Fexofenadine, HCl, fexofenadine(hclform), Fexofenadine hydrochloride [USAN:USP], MDL 16.455, TELFAST BD, FexofenadineHydrochloride, AC1L1Y6V, AC1Q3E6W, C32H39NO4.HCl, SCHEMBL40914, MLS001306422, MLS001332493, MLS001332494, FEXOFENADINE(HCL FORM), SPECTRUM1504179, CHEBI:5051, CHEMBL1200618, DTXSID5048716, CTK8B4006, HY-B0801A, MolPort-003-666-536, RRJFVPUCXDGFJB-UHFFFAOYSA-N, 2S068B75ZU, MDL 16455A, Pharmakon1600-01504179, KS-000011XN, Tox21_113125, ANW-43654, CF0042, NSC758678, s3208, AKOS015907422, Tox21_113125_1, AB07499, CCG-213275, CS-4483, KS-1057, NC00724, NSC-758678, RP17816, RTR-006346, alpha-(4-(1-carboxy-1-methylethyl)phenyl)-4-hydroxydiphenylmethyl-1-piperidinebutanol, Fexofenadine hydrochloride (JP17/USAN), NCGC00015453-02, NCGC00015453-08, NCGC00092389-01, NCGC00095906-01, NCGC00095906-02, (+-)-p-(1-Hydroxy-4-(4-(hydroxydiphenylmethyl)piperidino)butyl)-alpha-methylhydratropic acid hydrochloride, 2-[4-[1-Hydroxy-4-[4-(hydroxy-diphenyl-methyl)-1-piperidyl]-butyl]phenyl]-2-methyl-propanoicacidhydrochloride, AC-24745, BR-72915, CPD000718798, SAM002700173, Fexofenadine hydrochloride, >98% (HPLC), AB0011964, KB-222041, LS-173025, TR-006346, 4CH-009369, A3371, F0698, FT-0631183, M-016455-O, BIM-0050472.0001, CARBOXYTERFENADINE,TERFENADINECARBOXYLATE, D00671, J10191, S-5170, 452F218, J-505843, SR-01000075889-6, Z2210694607, Fexofenadine hydrochloride, European Pharmacopoeia (EP) Reference Standard, 2-[4-(1-hydroxy-4-{4-[hydroxy(diphenyl)methyl]piperidin-1-yl}butyl)phenyl]-2-methylpropans, Fexofenadine HCl, Pharmaceutical Secondary Standard; Certified Reference Material, Fexofenadine hydrochloride, United States Pharmacopeia (USP) Reference Standard, 2-(4-(1-HYDROXY-4-(4-(HYDROXYDIPHENYLMETHYL)PIPERIDIN-1-YL)BUTYL)PHENYL)-2-METHYLPROPANOIC ACID HCL, 2-(4-(1-Hydroxy-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butyl)phenyl)-2-methylpropanoic acid hydr, 2-(4-(1-HYDROXY-4-[4-(HYDROXY-DIPHENYL-METHYL)-PIPERIDIN-1-YL]-BUTYL)-PHENYL)-2-METHYL-PROPIONIC ACID HYDROCHLORIDE, 2-(4-{1-Hydroxy-4-[4-(hydroxy-diphenyl-methyl)-piperidin-1-yl]-butyl}-phenyl)-2-methyl-propionic acid; hydrochloride, 2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid hydrochloride, 2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid;hydrochloride, 4-[(4-(hydroxydiphenylmethyl)-1-piperidinyl]-1-hydroxybutyl]-alpha,alpha-dimethylbenzeneacetic acid hydrochloride, 4-[1-HYDROXY-4-[4-(HYDROXYDIPHENYLMETHYL)-1-PIPERIDINYL]BUTYL]-ALPHA,ALPHA-DIMETHYL-BENZENEACETIC ACID, HYDROCHLORIDE (1:1), 4-[4-[4-(Hydroxydiphenylmethyl)-1-pieridinyl]-1-hydroxybutyl]-alpha,alpha-dimethylbenzeneacetic acid hydrochloride, 4-[4-[4-(hydroxydiphenylmethyl)-1-piperidinyl]-1-hydroxybutyl]-alpha,alpha-dimethylbenzeneacetic acid hydrochloride, Benzeneacetic acid, 4-(1-hydroxy-4-(4-(hydroxydiphenylmethyl)-1-piperidinyl)butyl)-alpha,alpha-dimethyl-, hydrochloride, Benzeneacetic acid, 4-(1-hydroxy-4-(4-(hydroxydiphenylmethyl)-1-piperidinyl)butyl)-alpha,alpha-dimethyl-, hydrochloride, (+-)-, MolPort-000-846-065, MCULE-5306097997, AKOS015896119, AKOS015896444, A807389, I06-1628, I06-1869, hydron; 2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]butyl]phenyl]-2-methylpropanoic acid; chloride, hydron; 2-methyl-2-[4-[1-oxidanyl-4-[4-[oxidanyl(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]propanoic acid; chloride


ID: 2005

chemical graph of compound 2005



InChIKey: RRJLJKRFFRZRAF-UHFFFAOYSA-N
SMILES: COC1=C(C=C2C(=C1)CCN2C(=O)NC3=CC(=CC(=C3)C4=CN=CC=C4)F)C(F)(F)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 443390
synonyms found at PubChem are:
SB 228357, 181629-93-6, SB-228357, UNII-5RDN2E8E97, SB228357, Tocris-1375, CHEMBL14276, 5RDN2E8E97, CHEBI:8979, N-[3-FLUORO-5-(3-PYRINDYL)PHENYL]-2,3-DIHYDRO-5-METHOXY-6-(TRIFLUOROMETHYL)-1H-INDOLE-1-CARBOXAMIDE, N-[3-Fluoro-5-(3-pyridinyl)phenyl]-5-methoxy-6-(trifluoromethyl)-1-indolinecarboxamide, N-(3-fluoro-5-pyridin-3-ylphenyl)-5-methoxy-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide, N-[3-Fluoro-5-(3-pyridinyl)phenyl]-2,3-dihydro-5-methoxy-6-(trifluoromethyl)-1H-indole-1-carboxamide, SR-01000075936, AC1L9EKQ, Lopac-S-2318, J1.060.588A, D05NWH, GTPL192, SCHEMBL7042732, DTXSID9042621, MolPort-019-993-258, RRJLJKRFFRZRAF-UHFFFAOYSA-N, HMS3267B20, ZINC601841, BDBM50086056, AKOS024456558, CCG-204709, VI30417, N-(3-(3-Pyridinyl)-5-fluorophenyl)-5-methoxy-6-(trifluoromethyl)indoline-1-carboxamide, NCGC00015935-01, NCGC00015935-02, NCGC00015935-03, NCGC00015935-04, NCGC00015935-05, NCGC00015935-07, NCGC00025130-01, NCGC00025130-02, NCGC00025130-03, 1H-Indole-1-carboxamide, N-(3-fluoro-5-(3-pyridinyl)phenyl)-2,3-dihydro-5-methoxy-6-(trifluoromethyl)-, ZB014559, KB-300794, B6709, EU-0100620, FT-0643749, C11742, S 2318, A812626, C-22250, L001214, J-011603, SR-01000075936-1, SR-01000075936-3, BRD-K15424032-001-01-0, N-(3-Fluoro-5-(pyridin-3-yl)phenyl)-5-methoxy-6-(trifluoromethyl)indoline-1-carboxamide, N-[3-fluoro-5-(3-pyridyl)phenyl]-5-methoxy-6-(trifluoromethyl)indoline-1-carboxamide, 1H-Indole-1-carboxamide,N-[3-fluoro-5-(3-pyridinyl)phenyl]-2,3-dihydro-5-methoxy-6-(trifluoromethyl)-, 5-Methoxy-6-trifluoromethyl-2,3-dihydro-indole-1-carboxylic acid (3-fluoro-5-pyridin-3-yl-phenyl)-amide, N-(3-fluoranyl-5-pyridin-3-yl-phenyl)-5-methoxy-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide, N-(3-fluoro-5-pyridin-3-ylphenyl)-5-methoxy-6-(trifluoromethyl)-2,3-dihydro-1H-indole-1-carboxamide, N-[3-fluoro-5-(3-pyridinyl)phenyl]-5-methoxy-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide, N-[3-Fluoro-5-(3-pyridyl)phenyl]-2,3-dihydro-5-methoxy-6(trifluoromethyl)-1H-indole-1-carboxamide


ID: 2006

chemical graph of compound 2006



InChIKey: RRNSPXUFTKJIEZ-UHFFFAOYSA-N
SMILES: C1=CC(=CC(=C1)F)C2=C(N=CS2)C(=O)NCCN.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5311308
synonyms found at PubChem are:
Ro 41-1049 hydrochloride, UNII-19Z49HUF4G, RO-41-1049 hydrochloride, Ro 41-1049 (hydrochloride), N-(2-Aminoethyl)-5-(3-fluorophenyl)-4-thiazolecarboxamide hydrochloride, 19Z49HUF4G, 127917-66-2, AC1NSKEH, MLS000860021, SCHEMBL1665880, CHEMBL1256290, IN1987, AKOS030526380, CS-5591, HY-100027A, LP01113, Ro-411049, 4-Thiazolecarboxamide, N-(2-aminoethyl)-5-(3-fluorophenyl)-, hydrochloride (1:1), NCGC00094383-01, SMR000326879, RT-015422, EU-0101113, R-107, SR-01000075635, J-005497, SR-01000075635-2, N-(2-aminoethyl)-5-(3-fluorophenyl)thiazole-4-carboxamide hydrochloride, N-(2-aminoethyl)-5-(m-fluorophenyl)-4-thiazole carboxamide hydrochloride, N-(2-aminoethyl)-5-(3-fluorophenyl)-1,3-thiazole-4-carboxamide hydrochloride


ID: 2007

chemical graph of compound 2007



InChIKey: RRUDCFGSUDOHDG-UHFFFAOYSA-N
SMILES: CC(=O)NO

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 1990
synonyms found at PubChem are:
acetohydroxamic acid, N-Hydroxyacetamide, 546-88-3, Methylhydroxamic acid, Acetylhydroxamic acid, Acetic acid, oxime, Acetohydroximic acid, Lithostat, N-Acetylhydroxylamine, Acetamide, N-hydroxy-, Acethydroxamsaure, Acethydroxamsaeure, cetohyroxamic acid, Acethydroxamic acid, Acetohydroxamate, N-Acetyl hydroxyacetamide, AHA, Hydroxylamine, N-acetyl-, Acido acetohidroxamico, Acide acetohydroxamique, Acidum acetohydroxamicum, Acetyl hydroxyamino, Acethydroxamsaeure [German], Acide acetohydroxamique [French], Acido acetohidroxamico [Spanish], Acidum acetohydroxamicum [Latin], ACETOHYDROXAMICACID, acetic acid oxime, Lithostat (TN), UNII-4RZ82L2GY5, ethanehydroxamic acid, NSC 176136, CCRIS 1730, HSDB 3585, Acetohydroxamic acid [USAN:INN], N-hydroxyacetimidic acid, N-hydroxyethanimidic acid, EINECS 208-913-8, AI3-62232, 4RZ82L2GY5, Acetohydroxamic acid (USP/INN), CHEBI:27777, RRUDCFGSUDOHDG-UHFFFAOYSA-N, NCGC00094576-01, DSSTox_CID_2546, WLN: QMV1, DSSTox_RID_76622, DSSTox_GSID_22546, S14-0751, CAS-546-88-3, acetohydroxamsaure, Acetic acid|oxime, N-Oxylatoacetamide, acethydroximic acid, Acetohyroxamic acid, Acetyl hydroxyamine, Prestwick_38, n-hydroxy-acetamide, N-oxidanylethanamide, acetohydroxarnic acid, SJX HLdmMAH, sJX`HLdmMAH`, zlchem 200, Acetohydroxamic acid [USAN:USP:INN], methyl hydroximic acid, Spectrum_000020, ACMC-1AWJW, ACETYLHYDROXYLAMINE, AC1L1COH, Spectrum2_000109, Spectrum3_000285, Spectrum4_000138, Spectrum5_000812, CH3C(O)NHOH, CHEMBL734, D0R9BG, AC1Q1L7G, Acetohydroxamic acid, 98%, AHA (TN), BSPBio_001790, KBioGR_000556, KBioSS_000360, KSC269I4N, MLS001076662, Acetamide, N-hydroxy-(9CI), DivK1c_000821, SPECTRUM1500103, SPBio_000098, Acetamide, N-hydroxy- (9CI), DTXSID7022546, Acetohydroxamic acid, 98% 1g, CHEBI:49029, CTK1G9446, CTK8A6224, HMS502J03, KBio1_000821, KBio2_000360, KBio2_002928, KBio2_005496, KBio3_001290, KS-00000UQU, NSC5073, ZLC0003, MolPort-001-769-610, MolPort-028-751-555, NINDS_000821, ACETOHYDROXAMIC ACID (AHA), HMS1920A07, HMS2091G07, HMS2231M17, Pharmakon1600-01500103, ACN-S002461, ACT05768, HY-B1235, NSC-5073, ZINC4658603, Tox21_111301, ANW-32160, BDBM50099857, CA0112, CCG-38927, MFCD00009994, NSC176136, NSC755855, s4602, AKOS000172340, AKOS025395628, Tox21_111301_1, AB01014, CS-4881, DB00551, EBD2201963, MCULE-2682231025, NSC-176136, NSC-755855, RTR-019336, IDI1_000821, NCGC00094576-02, NCGC00094576-03, NCGC00094576-05, AJ-51852, AN-21371, BP-13320, BR-43984, CJ-12199, KB-47074, LS-13067, SC-18498, SMR000499570, SBI-0051270.P003, AB0010594, DB-052632, TR-019336, A0051, AM20100343, FT-0621796, ST24033130, EN300-36948, 46A883, C06808, D00220, M-3701, AB00051907_07, A830321, SR-01000763642, I08-0057, SR-01000763642-2, W-105609, Acetohydroxamic acid, United States Pharmacopeia (USP) Reference Standard


ID: 2008

chemical graph of compound 2008



InChIKey: RSDDHGSKLOSQFK-RVDMUPIBSA-N
SMILES: CC(=CCC/C(=C/COC1=CC2=C(C=C1)C=CC(=O)O2)/C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 1550607
synonyms found at PubChem are:
Auraptene, Aurapten, 7-Geranyloxycoumarin, 495-02-3, UNII-F79I1ZEL2E, F79I1ZEL2E, RSDDHGSKLOSQFK-RVDMUPIBSA-N, 7-[(2E)-3,7-dimethylocta-2,6-dienoxy]chromen-2-one, (E)-7-((3,7-Dimethylocta-2,6-dien-1-yl)oxy)-2H-chromen-2-one, 7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-2H-chromen-2-one, SR-01000758940, Feronialactone, 7-([(2E)-3,7-Dimethyl-2,6-octadienyl]oxy)-2H-chromen-2-one, 7-{[(2E)-3,7-dimethyl-2,6-octadienyl]oxy}-2H-chromen-2-one, CCRIS 8835, 2H-1-Benzopyran-2-one, 7-((3,7-dimethyl-2,6-octadienyl)oxy)-, (E)-, 2H-1-Benzopyran-2-one, 7-[(3,7-dimethyl-2,6-octadienyl)oxy]-, (E)-, 7-O-geranylumbelliferone, AC1LT3MK, UPCMLD-DP061, Coumarin, 7-(geranyloxy)-, MLS001049098, SPECTRUM1505176, CHEMBL307341, MEGxp0_000091, SCHEMBL2535029, SCHEMBL2535034, 7-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-2H-1-benzopyran-2-one, Auraptene, >=98% (HPLC), UPCMLD-DP061:001, ACon1_000071, CHEBI:93486, CHEBI:134355, MolPort-001-740-270, HMS2270C13, NP344, 29527-66-0, BCP23751, ZINC1658901, BDBM50361373, NSC711511, STL457597, AKOS015969736, CCG-208550, MCULE-3823939164, NSC-711511, NCGC00096070-01, NCGC00096070-03, NCGC00096070-04, NCGC00096070-05, NCGC00168822-01, 4CN-1163, CJ-26819, SMR000386931, W1305, SR-01000758940-3, SR-01000758940-4, 7-(3,7-Dimethyl-octa-2,6-dienyloxy)-chromen-2-one, 7-[(3,7-Dimethyl-2,6-octadienyl)oxy]-(E)-Coumarin, BRD-K85013741-001-05-9, Coumarin, 7-[(3,7-dimethyl-2,6-octadienyl)oxy]-, (E)-, (E)-7-(3,7-dimethylocta-2,6-dienyloxy)-2H-chromen-2-one, 7-([(2E)-3,7-Dimethyl-2,6-octadienyl]oxy)-2H-chromen-2-one #, 7-(3,7-Dimethyl-2,6-octadienyl)oxy-2H-1-benzopyran-2-one, 9CI, 2H-1-Benzopyran-2-one, 7-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-, 2H-1-Benzopyran-2-one,7-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-, 7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-2H-1-benzopyran-2-one, NCGC00096070-07!7-[(2E)-3,7-dimethylocta-2,6-dienoxy]chromen-2-one


ID: 2009

chemical graph of compound 2009



InChIKey: RSEPBGGWRJCQGY-RBRWEJTLSA-N
SMILES: CCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 13791
synonyms found at PubChem are:
estradiol valerate, 979-32-8, Delestrogen, Estraval, Neofollin, Progynova, Femogex, Progynon-Depot, Estradiol 17-valerate, Oestradiol valerate, Atladiol, Climaval, Deladiol, Duratrad, Pharlon, Estate, Dura-estradiol, Exten strone, Depo estro med, Repo-Estra, Delestrogen 4X, Estraval PA, Estraval 2X, Estroval-10, Delahormone unimatic, Estradiol valerianate, Depo-Estro-Med, Femogen-L.A., Cyclocur, Gynokadin, Merimono, Nuvelle, Pelanin, Postoval, Primogyna, Ronfase, Estradiol Depot, Primogyn-Depot, Gynogen L.A. 20, Gynogen L.A. 40, Gynogen L.A. 10, Valergen, ESTRADIOL, 17-VALERATE, Estradiol 17beta-valerate, Estradiol valerate (VAN), component of Ditate, UNII-OKG364O896, CCRIS 5571, Estradioli valeras [INN-Latin], Oestradiol-17b-valerate, Valerate d'estradiol [INN-French], EINECS 213-559-2, NSC 17590, Valerato de estradiol [INN-Spanish], component of Deluteval 2X, beta-Estradiol 17-valerate, 17-BETA-ESTRADIOL 17-VALERATE, Estradiol 17.beta.-valerate, component of Mal-O-Fem L.A, MLS000028449, CHEBI:31561, RSEPBGGWRJCQGY-RBRWEJTLSA-N, OKG364O896, NSC-17590, 3-Hydroxy-17beta-valeroyloxyestra-1,3,5(10)-triene, SMR000058346, ST075188, [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate, 17-pentanoyl-estra-1,3,5(10)-triene-3,17beta-diol, Estra-1,3,5(10)-triene-3,17-diol (17-beta)-, 17-pentanoate, Estra-1,3,5(10)-triene-3,17-diol(17beta)-, 17-pentanoate, Estradioli valeras, estradiol-17-valerate, (1S,11S,14S,15S,10R)-5-hydroxy-15-methyltetracyclo[8.7.0.0<2,7>.0<11,15>]hepta deca-2,4,6-trien-14-yl pentanoate, Valerate d'estradiol, Valerato de estradiol, Pelanin depot, Gynogen LA, Deladumone (TN), Femogen-L.A, NCGC00094673-01, CPD000058346, Estradiol valerate [USAN:INN:JAN], Gynogen L.A.10, Estradiol valerate [USP:INN:BAN:JAN], Opera_ID_444, Estradiol 17?-valerate, B-Estradiol 17-valerate, DSSTox_CID_3004, AC1L22HN, CHEMBL1511, DSSTox_RID_76827, DSSTox_GSID_23004, SCHEMBL40563, MLS001146931, ARONIS24416, 17|A-Estradiol-17-valerate, GTPL7655, DTXSID8023004, BBC/580, MolPort-002-507-065, HMS2232L17, HMS3259C12, HMS3715B21, (8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-yl pentanoate, BCP11918, EBD28143, Estradiol valerate (JAN/USP/INN), HY-B0672, NSC17590, ZINC3881556, Tox21_111312, Estra-1,3,5(10)-triene-3,17-diol (17.beta.)-, 17-pentanoate, LMST02010039, MFCD00056541, s3149, SBB080821, AKOS005267158, API0002610, CCG-221130, CS-2904, KS-5213, MCULE-6732064308, NC00560, beta-Estradiol 17-valerate, 98% 1g, CAS-979-32-8, LS-64737, AB0106305, B1506, E0876, ST24046695, C12859, D01413, AB00382980_15, 124683-EP2295426A1, 124683-EP2295427A1, 979E328, A845765, SR-01000003061, Q-201506, SR-01000003061-3, 1,3,5(10)-Estratriene-3,17beta-diol 17-pentanote, BRD-K66766661-001-19-2, pentanoate d'estra-1,3,5(10)-tri ne-3-ol-17|A-yle, (17.beta.)-Estra-1,3,5(10)-triene-3,17-diol 17-valerate, (17beta)-3-hydroxyestra-1(10),2,4-trien-17-yl pentanoate, Estra-1,5(10)-triene-3,17-diol (17.beta.)-, 17-pentanoate, Estradiol-17-valerate; 1,3,5(10)-Estratriene-3,17b-diol 17-pentanote, (1S,11S,14S,15S,10R)-5-hydroxy-15-methyltetracyclo[8.7.0.0<2,7>.0<11,15>]hepta deca-2(7),3,5-trien-14-yl pentanoate, [(8R,9S,13S,14S,17S)-13-methyl-3-oxidanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate, 69557-95-5, 907-12-0, pentanoic acid [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] ester


ID: 2010

chemical graph of compound 2010



InChIKey: RSLNRVYIRDVHLY-UHFFFAOYSA-N
SMILES: CC(C)(C)NCC(C1=CC=CC=C1Cl)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 41991
synonyms found at PubChem are:
Hokunalin, Brelomax sirup, Chlobamol hydrochloride, C 78, 1-(o-Chlorophenyl)-2-tert-butylamino ethanol hydrochloride, alpha-(tert-Butylamino)methyl-2-chlorobenzyl alcohol hydrochloride, o-Chloro-alpha-((tert-butylamino)methyl)benzylalcohol hydrochloride, Benzyl alcohol, alpha-((tert-butylamino)methyl)-o-chloro-, hydrochloride, Benzenemethanol, 2-chloro-alpha-(((1,1-dimethylethyl)amino)methyl)-, hydrochloride, BENZYL ALCOHOL, alpha-(tert-BUTYLAMINO)METHYL-2-CHLORO-, HYDROCHLORIDE, C12H18ClNO.HCl, AC1L26VM, AN-15532, LS-42737, tert-butyl-[2-(2-chlorophenyl)-2-hydroxyethyl]azanium chloride, tert-butyl-[2-(2-chlorophenyl)-2-hydroxy-ethyl]ammonium chloride, Tulobuterol hydrochloride, 56776-01-3, 2-(tert-butylamino)-1-(2-chlorophenyl)ethanol hydrochloride, Tulobuterol HCl, Berachin, Lobuterol, 2-tert-Butylamino-1-(2-chlorophenyl)ethanol hydrochloride, C-78, CHEBI:32272, NCGC00094412-02, Hokunalin (TN), DSSTox_CID_25805, DSSTox_RID_81143, DSSTox_GSID_45805, alpha-((tert-Butylamino)methyl)-o-chlorobenzyl alcohol hydrochloride, CAS-56776-01-3, HN-078, SR-01000076165, 2-(tert-butylamino)-1-(2-chlorophenyl)ethanol;hydrochloride, Tulobuterol hydrochloride [JAN], ALPHA-[(TERT-BUTYLAMINO)METHYL]-O-CHLOROBENZYL ALCOHOL HYDROCHLORIDE, Tulobuterol, HCl, Respacal (TN), AC1NWAYM, PubChem13280, SCHEMBL123786, SPECTRUM1503954, Tulobuterol Hydrochloride,(S), CHEMBL1256478, DTXSID3045805, CTK8B4317, MolPort-003-981-175, Tulobuterol hydrochloride (JP17), HMS1922O06, Pharmakon1600-01503954, 41570-61-0 (Parent), BCP04486, KS-00000H8V, Tox21_111277, Tox21_501149, ANW-44683, CCG-39067, MFCD00214398, NSC758643, AKOS015894947, Tox21_111277_1, AB04864, API0004541, CS-W012449, HY-W011733, KS-5185, LP01149, MCULE-1663996986, NSC-758643, NCGC00016034-05, NCGC00094412-01, NCGC00094412-03, NCGC00094412-04, NCGC00261834-01, AK-54933, SC-26623, AX8156060, KB-224631, TR-019893, 4CH-007757, EU-0101149, FT-0630693, ST24027671, ST51015148, C12798, D01362, J10478, T 6050, 776T013, I06-038, I06-0038, SR-01000076165-1, SR-01000076165-5, 2-[(tert-butyl)amino]-1-(2-chlorophenyl)ethan-1-ol, chloride, Tulobuterol hydrochloride, VETRANAL(TM), analytical standard, 99798-69-3


ID: 2011

chemical graph of compound 2011



InChIKey: RSNLDCUXHLFIRF-UHFFFAOYSA-N
SMILES: CC(=O)C1=C(C=CC=C1OCC2=CC=C(C=C2)OC)OC

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MJ Kurth" "LJ Galietta" "MJ Haddadin" "MF Springsteel" "MH Nantz" "K By" "AS Verkman" "M Eda" "EJ Niedzinski"


CID is 56973356
synonyms found at PubChem are:
1234015-61-2, 2'-Methoxy-6'-(4-methoxybenzyloxy)acetophenone, 1-(2-Methoxy-6-((4-methoxybenzyl)oxy)phenyl)ethanone, 1-(2-methoxy-6-(4-methoxybenzyloxy)phenyl)ethanone, 1-[2-Methoxy-6-(4-methoxybenzyloxy)phenyl]ethanone, SCHEMBL1971024, CTK8E1755, MolPort-023-222-619, RSNLDCUXHLFIRF-UHFFFAOYSA-N, CS-M3292, 4472AA, QC-106, ZINC72319662, AKOS016000420, ACN-001419, TRA0035849, KS-00000C51, CS-11434, SY020915, TZ001155, AB0059517, AJ-120990, AX8244245, KB-213201, TC-307120, FT-0686240, Z-4594, 2/'-Methoxy-6/'-(4-methoxybenzyloxy)acetophenone, 1-{2-methoxy-6-[(4-methoxyphenyl)methoxy]phenyl}ethanone


ID: 2012

chemical graph of compound 2012



InChIKey: RSRFPGRMZHUKON-UHFFFAOYSA-N
SMILES: CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=NC(=O)C(=C(N3)C)C)C)C

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"N Pedemonte" "K Du" "GL Lukacs" "E Caci" "LJ Galietta" "AS Verkman" "O Zegarra-Moran"


CID is 695250
synonyms found at PubChem are:
AC1LEZVW, Oprea1_293092, Oprea1_437607, SCHEMBL838117, ZINC69303, MolPort-000-738-821, STK096804, AKOS000622026, MCULE-8185619622, BAS 01306736, EU-0073379, SR-01000450181, SR-01000450181-1, A2237/0094179, 5,6-Dimethyl-2-(4,6,7-trimethyl-quinazolin-2-ylamino)-1H-pyrimidin-4-one, 5,6-dimethyl-2-[(4,6,7-trimethyl-2-quinazolinyl)amino]-4(1H)-pyrimidinone, 5,6-dimethyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one, 5,6-dimethyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]pyrimidin-4(1H)-one


ID: 2013

chemical graph of compound 2013



InChIKey: RSRUDTPYRBLHEO-UHFFFAOYSA-N
SMILES: CN1CCC2=C(CC1)C(=CC=C2)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 123981
synonyms found at PubChem are:
benalfocin, Skf 86466, SK&F-86466, 73943-10-9, SK&F 86466, UNII-YCN2U5UGIQ, 6-chloro-3-methyl-2,3,4,5-tetrahydro-1h-3-benzazepine, YCN2U5UGIQ, SKF-86466, 6-Chloro-2,3,4,5-tetrahydro-3-methyl-1H-3-benzazepine, CHEBI:8986, CHEMBL123349, 1H-3-Benzazepine, 6-chloro-2,3,4,5-tetrahydro-3-methyl-, SK-86466, 7713-86-2, 6-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepine, MLS002172470, SMR001254100, Lopac-S-1563, D06UBB, AC1L3XO4, Lopac0_001056, AC1Q3P63, SCHEMBL8083358, BDBM66983, CTK8D9445, DTXSID70224650, cid_10220250, RSRUDTPYRBLHEO-UHFFFAOYSA-N, ZINC900633, PDSP1_000725, PDSP2_000715, AKOS030558322, CCG-205133, MB01559, NCGC00015930-01, NCGC00015930-02, NCGC00015930-03, NCGC00162330-01, KB-293371, LS-186796, LS-187466, C10970, 6-chloro-N-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine, 6-CHLORO-3-METHYL-2,3,4,5-TETRAHYDRO-BENZO[D]AZEPINE, 6-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepine;hydrochloride, 6-chloranyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepine;hydrochloride


ID: 2014

chemical graph of compound 2014



InChIKey: RSYUFYQTACJFML-UKRRQHHQSA-N
SMILES: C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC=C(C=C3)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 443639
synonyms found at PubChem are:
(-)-Epiafzelechin, epiafzelechin, epi-Afzelechin, 24808-04-6, EPIAFZELECHIN (2R,3R)(-), CHEMBL159303, CHEBI:31028, (2R,3R)-2-(4-hydroxyphenyl)chromane-3,5,7-triol, 2,3-cis-epiafzelechin, (2R,3R)-epiafzelechin, AC1L9EYB, Spectrum2_001755, Spectrum3_001685, BSPBio_003210, SPECTRUM202178, SCHEMBL557061, SPBio_001890, KBio3_002430, MolPort-003-665-792, ZINC1721694, BDBM50240892, CCG-38806, LMPK12020036, AKOS032948425, SDCCGMLS-0066933.P001, NCGC00178206-01, 2-(4-hydroxyphenyl)chromane-3,5,7-triol, W1558, C12128, SR-05000002523, SR-05000002523-1, BRD-K90607708-001-02-9, BRD-K90607708-001-03-7, (2R,3R)-2-(4-Hydroxy-phenyl)-chroman-3,5,7-triol, (2R,3R)-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol, 2H-1-Benzopyran-3,5,7-triol,3,4-dihydro-2-(4-hydroxyphenyl)-, (2R,3R)-


ID: 2015

chemical graph of compound 2015



InChIKey: RTIXKCRFFJGDFG-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5281607
synonyms found at PubChem are:
chrysin, 480-40-0, 5,7-Dihydroxyflavone, Chrysine, 5,7-Dihydroxy-2-phenyl-4H-chromen-4-one, Crysin, 5,7-dihydroxy-2-phenylchromen-4-one, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-phenyl-, UNII-3CN01F5ZJ5, NSC-407436, FLAVONE, 5,7-DIHYDROXY-, EINECS 207-549-7, NSC407436, 5,7-Dihydroxy-2-phenyl-4H-1-benzopyran-4-one, CHEMBL117, NSC 407436, 5,7-Dihydroxy-2-phenyl-chromen-4-one, BRN 0233276, 3CN01F5ZJ5, CHEBI:75095, RTIXKCRFFJGDFG-UHFFFAOYSA-N, 5,7-Dihydroxy-2-phenyl-4H-benzo(b)pyran-4-one, CAS-480-40-0, 5,7-dihydroxy-2-phenyl-4H-benzo[b]pyran-4-one, SMR000112318, SR-01000765660, Chrysinic acid, 3ebo, 4des, 57D, Chrysin,(S), 5,7-diOH-Flavone, PubChem9839, Flavone,7-dihydroxy-, Chrysin, 97%, AC1NQYPV, Ois 3, Spectrum_000245, Prestwick0_000889, Prestwick1_000889, Prestwick2_000889, Prestwick3_000889, Spectrum2_000753, Spectrum3_001399, Spectrum4_000780, Spectrum5_001503, DSSTox_CID_2396, D01UYI, Chrysin, analytical standard, DSSTox_RID_76571, DSSTox_GSID_22396, Oprea1_045160, SCHEMBL44474, BSPBio_000678, BSPBio_002514, BSPBio_003018, KBioGR_001200, KBioSS_000725, 5-18-04-00076 (Beilstein Handbook Reference), MLS000697728, MLS001074879, MLS006011841, BIDD:ER0484, DivK1c_000614, SPECTRUM1500709, SPECTRUM1505144, SPBio_000766, SPBio_002897, BDBM7461, BPBio1_000746, GTPL8789, MEGxp0_001416, DTXSID1022396, ACon1_000087, cid_5281607, CTK4J0553, HMS501O16, KBio1_000614, KBio2_000725, KBio2_003293, KBio2_005861, KBio3_002238, MolPort-001-742-013, NINDS_000614, HMS1570B20, HMS1921E20, HMS2097B20, HMS2268I23, HMS3468N08, HMS3655L20, 5,7-Dihydroxyflavone, 98% 5g, ALBB-015581, BCP22863, KS-00000HC3, ZINC3872070, Tox21_302335, ANW-43827, BBL010449, CC-079, CCG-40148, LMPK12110189, MFCD00006834, s2281, SBB012459, STK801609, AKOS000275936, BCP9000172, CS-7531, GS-0927, MCULE-7719714939, RTR-017608, SDCCGMLS-0066586.P001, IDI1_000614, SMP1_000070, NCGC00016456-01, NCGC00016456-02, NCGC00016456-03, NCGC00016456-04, NCGC00016456-05, NCGC00016456-06, NCGC00016456-07, NCGC00016456-08, NCGC00016456-09, NCGC00016456-10, NCGC00016456-12, NCGC00094842-01, NCGC00094842-02, NCGC00094842-03, NCGC00094842-04, NCGC00094842-05, NCGC00168807-01, NCGC00168807-02, NCGC00168807-03, NCGC00168807-04, NCGC00255307-01, AC-10052, AN-45183, BC200220, HY-14589, KB-76197, LS-68972, NCI60_003886, SC-04753, SC-57642, ST069324, 5,7-bis(oxidanyl)-2-phenyl-chromen-4-one, AB0006577, AB1003937, NP-005901, TR-017608, 5,7-dihydroxy-2-phenyl-1-benzopyran-4-one, AB00513947, C1652, FT-0082809, FT-0619846, FT-0686390, N1336, 5,7-Dihydroxy-2-phenyl-4H-chromen-4-one #, 4H-1-Benzopyran-4-one,7-dihydroxy-2-phenyl-, 80C400, A-8723, C10028, S00112, A827426, I06-0226, SR-01000765660-3, SR-01000765660-4, 34B3B4AD-EEDD-4943-A1C6-8857D2FAA8E0, 5,7-Dihydroxy-2-phenyl-4H-1-benzopyran-4-one, 9CI, BRD-K22861715-001-07-5, BRD-K22861715-001-12-5, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-phenyl- (9CI), 4H-1,3-BENZODIOXIN-8-CARBONYL CHLORIDE,6-FLUORO-,M


ID: 2016

chemical graph of compound 2016



InChIKey: RTKIYNMVFMVABJ-UHFFFAOYSA-L
SMILES: CC[Hg]SC1=CC=CC=C1C(=O)[O-].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5908
synonyms found at PubChem are:
thimerosal, Thiomersal, Thiomersalate, Mercurothiolate, 54-64-8, Sodium merthiolate, Sodium ethylmercurithiosalicylate, MERTHIOLATE, Thimerosalate, Thimerosalum, Thimersalate, Thiomersalat, Thiomersalum, Thimerosol, Tiomersal, Ethylmercurithiosalicylate sodium, Ethylmercurithiosalicylic acid sodium salt, Elicide, Estivin, Merfamin, Merphol, Mertorgan, Merzonin, Nosemack, Tiomersale, Mercurothiolatum, Merzonin sodium, Aeroaid spray, Merthiolate salt, Merthiolate sodium, Vitaseptol Loesung, Merseptyl (VAN), Ethyl(2-mercaptobenzoato-S)mercury sodium salt, Elcide 73, Elcide 75, Tiomersale [DCIT], Caswell No. 766, o-(Ethylmercurithio)benzoic acid sodium salt, C9H9HgO2S.Na, Sodium ethylmercuric thiosalicylate, Tiomersal [INN-Spanish], Thiomersalum [INN-Latin], Sodium o-(ethylmercurithio)benzoate, Sodium 2-(ethylmercurithio)benzoate, Ethylmercurithiosalicylate sodium salt, UNII-2225PI3MOV, ((o-Carboxyphenyl)thio)ethylmercury sodium salt, Ethylmerkurithiosalicilan sodny, CCRIS 4839, HSDB 7151, NSC 4794, EINECS 200-210-4, [(o-Carboxyphenyl)thio]ethylmercury sodium salt, EPA Pesticide Chemical Code 078901, Ethylmerkurithiosalicilan sodny [Czech], Ethyl (sodium o-mercaptobenzoato)mercury, Ethylmercurithiosalicyclic acid, sodium salt, 2225PI3MOV, CHEBI:9546, Mercurate(1-), ethyl(2-mercaptobenzoato(2-)-O,S)-, sodium, Thiomersal (INN), Thiomersal [INN], Mercury, ethyl(2-mercaptobenzoate-S)-, sodium salt, Mercury, ethyl(2-mercaptobenzoato-S)-, sodium salt, Mercury, ((o-carboxyphenyl)thio)ethyl-, sodium salt, Mercurate(1-), ethyl(o-mercaptobenzoato(2-))-, sodium, NCGC00094791-01, Vitaseptol, Mercurate(1-), ethyl(2-mercaptobenzoate(2-)-O,S)-, sodium salt, DSSTox_CID_5540, Ethyl(2-mercaptobenzoato-S)mercury, sodium salt, Mercury-([o-carboxyphenyl]thio)ethyl sodium salt, DSSTox_RID_77823, DSSTox_GSID_25540, sodium (2-carboxylatophenyl)sulfanyl-ethyl-mercury, SET, Mercury, ethyl (2-mercaptobenzoato-S)-, sodium salt, MLS001336050, Mercurate(1-), ethyl(2-(mercapto-kappaS)benzoato(2-)-kappaO)-, sodium, CAS-54-64-8, (2-(Ethylmercuriomercapto)benzoic acid sodium salt, Thimerosal [USP:JAN], SMR000875330, Thimerosal [USAN:JAN], sodium;(2-carboxylatophenyl)sulfanyl-ethylmercury, Merthiolate (TN), Prestwick_1021, Thimerosal (JAN/USP), Epitope ID:119682, SCHEMBL3525, MLS001336049, SPECTRUM1500572, Thimerosal, EP/BP/USP grade, Thimerosal, analytical standard, DTXSID3025540, Thimerosal, >=97% (HPLC), HMS501O19, BIT0151, Thimerosal, >=95.0% (Hg), RTKIYNMVFMVABJ-UHFFFAOYSA-L, ZX-AFC000481, HMS1921E07, HMS2092M09, HMS2230I04, HMS3371N19, Thimerosal, BioXtra, 97-101%, Tox21_111331, Tox21_302176, 8171AF, CCG-39725, CT0192, GA6948, MFCD00013062, AKOS004910446, Tox21_111331_1, API0004391, DB11590, LS-1337, NCGC00094791-02, NCGC00164425-01, NCGC00178879-04, NCGC00255169-01, AN-41660, BP-30041, CC-34985, Ethylmercurithiosalicyclic acid sodium salt, FT-0603231, ST51015159, Thimerosal, meets USP testing specifications, sodium (2-carboxylatophenylthio)(ethyl)mercury, 2-(mercurapropylthio)benzoic acid, sodium salt, D00864, Mercury((o-carboxyphenyl)thio)ethyl sodium salt, sodium [(2-carboxylatophenyl)thio]-ethylmercury, T-3600, 2-(Ethylmercuriomercapto)benzoic acid sodium salt, A830286, C-21801, ((O-CARBOXYPHENYL)THIO) ETHYLMERCURY SODIUM SALT, sodium ethyl[2-(mercapto-kS)benzoato(2-)]mercurate(1-), Mercury, ethyl(hydrogen o-mercaptobenzoato)-, sodium salt, sodium [(2-carboxylatophenyl)sulfanyl](ethyl)mercurate(1-), Thimerosal, European Pharmacopoeia (EP) Reference Standard, sodium ethyl[2-(sulfanyl-kappaS)benzoato(2-)]mercurate(1-), Thimerosal, United States Pharmacopeia (USP) Reference Standard, Mercury, ethyl(hydrogen o-mercaptobenzoato)-, sodium salt (8CI), Thimerosal Ready Made Solution, 100 mg/mL in water, 0.2 mum filtered, Thimerosal, Pharmaceutical Secondary Standard; Certified Reference Material, Mercurate(1-), ethyl(2-(mercapto-kappaS)benzoato(2-)-kappaO)-, sodium (1:1), Mercurate(1-), ethyl[2-(mercapto-.kappa.S)benzoato(2-)-.kappa.O]-, sodium (1:1), 11004-81-2, 113170-85-7, 130995-49-2, 2141-27-7, 23065-35-2, 25948-50-9, 362653-08-5, 77536-61-9, 8030-32-8, 878791-13-0


ID: 2017

chemical graph of compound 2017



InChIKey: RTYBGDQNUBLFSW-XIJGOZNCSA-N
SMILES: C[C@]1(CCC[C@@H](C1)C(C)(C)NC(=O)CBr)NCC(COC2=CC=CC=C2CC=C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 11957482
synonyms found at PubChem are:
Bromoacetyl alprenolol menthane, Lopac0_000215, CHEMBL1398096, HMS3260L11, Tox21_500215, CCG-204310, LP00215, NCGC00162095-02, NCGC00260900-01, EU-0100215, SR-01000075728, SR-01000075728-1


ID: 2018

chemical graph of compound 2018



InChIKey: RTYJTGSCYUUYAL-YCAHSCEMSA-L
SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)C(=O)[O-])C(=O)[O-])C.[Na+].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 20933
synonyms found at PubChem are:
Carbenicillin disodium, 4800-94-6, carbenicillin sodium, Carbenicillin disodium salt, Carbecin, Sodium carbenicillin, Microcillin, Pyocianil, Hyoper, Geopen, Pyopen, Fugacillin, Gripenin, Pyoclox, Disodium carbenicillin, Piopen, Carbenicilline disodium, Anabactyl, BRL-2064, alpha-Carboxybenzylpenicillin disodium salt, Carboxybenzylpenicillin sodium, Carbenicillin (disodium), alpha-Carboxybenzylpenicillin sodium salt, GS 3159 disodium salt, Disodium alpha-carboxybenzylpenicillin, CP-15-639-2, BRL 2064, EINECS 225-360-8, NSC 111071, NSC-111071, CP 15639-2, CHEBI:34609, N-(2-Carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)-hept-6-yl)-2-phenylmalonamic acid disodium salt, Carbencillin Sodium, DSSTox_CID_25820, DSSTox_RID_81153, DSSTox_GSID_45820, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((carboxyphenylacetyl)amino)-3,3-dimethyl-7-oxo, disodium salt, (2S-(2alpha,5alpha,6beta))-, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((carboxyphenylacetyl)amino)-3,3-dimethyl-7-oxo, disodium salt, (6S-(2alpha,5alpha,6beta))-, Disodium (2S-(2alpha,5alpha,6beta))-6-(carboxylatophenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate, Malonamic acid, N-(2-carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)hept-6-yl)-2-phenyl-, disodium salt, CAS-4800-94-6, alpha-Carboxybenzylpenicillin, C17H16N2Na2O6S, Carbenicillin disodium [USAN], Prestwick_29, NCGC00094607-01, Carbenicillin disodium [USAN:USP], Carbencillin disodium, Geopen (TN), disodium carbenicillin(2-), AC1L2HA6, Carbenicillin sodium (JAN), SCHEMBL54797, Carbenicillin disodium (USP), SPECTRUM1500160, CHEMBL606260, DTXSID6045820, HMS502E17, HY-B0525A, KS-00000XUO, 4697-36-3 (Parent), BIC0109, 4697-36-3 (non-salt), MolPort-002-508-836, ZX-AFC000678, HMS1920I19, HMS2091O21, Tox21_111304, CCG-38928, MFCD00077683, s3179, AKOS016001461, Tox21_111304_1, API0001846, CS-2746, 4800-94-6 (Carbenicillin Disodium), NCGC00022579-05, AK-49821, AS-11636, LS-88732, oEUEthCaA(1)EO paragraph signthornAAENI, AX8041718, FT-0602935, ST24046282, C13967, D02190, Carbenicillin disodium, meets USP testing specifications, Carbenicillin disodium salt, 89.0-100.5% anhydrous basis, Carbenicillin disodium salt, BioReagent, plant cell culture tested, Carbenicillin sodium, European Pharmacopoeia (EP) Reference Standard, disodium 6beta-(2-carboxylato-2-phenylacetamido)-2,2-dimethylpenam-3alpha-carboxylate, disodium (2S,5R,6R)-3,3-dimethyl-6-[(3-oxido-3-oxo-2-phenylpropanoyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, disodium (2S,5R,6R)-6-{[carboxylato(phenyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, disodium;(2S,5R,6R)-6-[(2-carboxylato-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium (2S,5R,6R)-6-(2-carboxylato-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, Carbenicillin, Disodium Salt, 6-[(Carboxyphenylacetyl)-amino]-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylic Acid, 2Na, AKOS025293506, Carbenicillin sodium salt, Antibiotic for Culture Media Use Only, (2S,5R,6R)-6-[(2-Carboxy-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid disodium salt


ID: 2019

chemical graph of compound 2019



InChIKey: RTYOLBQXFXYMKY-UHFFFAOYSA-N
SMILES: C1=CC=C(C(=C1)CN(CC2=CC=CC=C2O)C3=CC(=C(C=C3)O)C(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3895
synonyms found at PubChem are:
lavendustin b, 125697-91-8, UNII-7T53EGQ52Z, 7T53EGQ52Z, IN1273, Benzoic acid,5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-, 5-[bis(2-hydroxybenzyl)amino]-2-hydroxybenzoic acid, 5-(Bis((2-hydroxyphenyl)methyl)amino)-2-hydroxybenzoic acid, 5-(bis(2-hydroxybenzyl)amino)-2-hydroxybenzoic acid, 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoic acid, 5-{bis[(2-hydroxyphenyl)methyl]amino}-2-hydroxybenzoic acid, ACMC-20c8gz, AC1L1GY8, AC1Q5V0Y, CHEMBL485258, SCHEMBL13228056, CTK4B4737, DTXSID40154854, MolPort-003-848-368, BCP20779, ZINC2504634, BDBM50025606, HSCI1_000118, AKOS030239802, CCG-208626, SMP2_000233, NCGC00163670-01, RT-013562, FT-0627735, 5-Amino-(N,N'-bis-2-hydroxybenzyl)salicylic acid, SR-05000002160, J-005264, SR-05000002160-2, BRD-K33781562-001-02-7, 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid, Benzoic acid, 5-(bis((2-hydroxyphenyl)methyl)amino)-2-hydroxy-


ID: 2020

chemical graph of compound 2020



InChIKey: RUBSCPARMVJNKX-UHFFFAOYSA-N
SMILES: CC1=NN=C(C2=CC3=C(C=C2C1)OCO3)C4=CC=C(C=C4)N.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 10042240
synonyms found at PubChem are:
GYKI 52466 hydrochloride, 192065-56-8, 4-(8-Methyl-9H-[1,3]dioxolo[4',5':4,5]benzo[1,2-d][1,2]diazepin-5-yl)aniline hydrochloride, 1-(4-Aminophenyl)-4-methyl-7,8-methylenedioxy-5H-2,3-benzodiazepine hydrochloride, GYKI 52466 dihydrochloride, SR-01000075453, EU-0100631, GYKI52466 hydrochloride, MLS002153395, SCHEMBL249675, CHEMBL1370663, DTXSID70434691, GYKI 52466 hydrochloride, solid, Tox21_500631, MFCD00153803, AKOS015891418, CCG-221935, LP00631, NCGC00093998-01, NCGC00261316-01, KB-52320, SMR000326939, RT-013152, 4-(8-Methyl-9H-[1,3]dioxolo[4',5', FT-0714197, G-119, ST24042997, I01-9502, J-000783, SR-01000075453-1, SR-01000075453-3


ID: 2021

chemical graph of compound 2021



InChIKey: RUDATBOHQWOJDD-BSWAIDMHSA-N
SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 10133
synonyms found at PubChem are:
chenodeoxycholic acid, Chenodiol, Chenix, Chenic acid, 474-25-9, Chenodeoxycholate, Chendol, Chenodesoxycholic acid, Gallodesoxycholic acid, Cdca, Anthropodeoxycholic acid, Chenofalk, Anthropodesoxycholic acid, Anthropododesoxycholic acid, Chenodesoxycholsaeure, Henohol, Xenbilox, Chenique Acid, Chenodiol [USAN], 3alpha,7alpha-Dihydroxy-5beta-cholan-24-oic acid, Sodium chenodeoxycholate, Acido chenodeoxicholico, Chenodesoxycholsaeure [German], Acide chenodeoxycholique, 7-alpha-Hydroxylithocholic acid, Acidum chenodeoxycholicum, Chenocholic acid, UNII-0GEI24LG0J, 3alpha,7alpha-Dihydroxy-5beta-cholanic acid, Acide chenodeoxycholique [INN-French], Acido chenodeoxicholico [INN-Spanish], Acidum chenodeoxycholicum [INN-Latin], Chendeoxycholic Acid, 3-alpha,7-alpha-Dihydroxycholanic acid, CCRIS 2195, EINECS 207-481-8, 3-alpha,7-alpha-Dihydroxycholansaeure [German], 3-alpha,7-alpha-Dihydroxycholansaeure, NSC 657949, 0GEI24LG0J, 3-alpha,7-alpha-Dihydroxy-5-beta-cholan-24-oic acid, 7alpha-hydroxylithocholic acid, CHEBI:16755, Cholan-24-oic acid, 3,7-dihydroxy-, (3alpha,5beta,7alpha)-, RUDATBOHQWOJDD-BSWAIDMHSA-N, Chenodiol (USAN), (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid, 5-beta-Cholan-24-oic acid, 3-alpha,7-alpha-dihydroxy-, (3alpha,5beta,7alpha,8xi)-3,7-dihydroxycholan-24-oic acid, DSSTox_CID_260, DSSTox_RID_75469, DSSTox_GSID_20260, Cholan-24-oic acid, 3,7-dihydroxy-, (3a,5b,7a)-, (3beta,7beta,8xi,9xi,14xi,17alpha)-3,7-dihydroxycholan-24-oic acid, Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-alpha)-, Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-alpha)- (9CI), 5beta-Cholanic acid-3alpha,7alpha-diol, (4R)-4-((1S,2S,7S,11S,5R,9R,10R,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo [8.7.0.0<2,7>.0<11,15>]heptadec-14-yl)pentanoic acid, (4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid, (R)-4-((3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, 5 beta-Cholanic acid-3,7-diol, Chenocedon, Chendal, Chenocol, Chenodal, Chenodex, Chenorm, Chenossil, Cholanorm, Fluibil, Hekbilin, Kebilis, Cholan-24-oic acid, 3,7-dihydroxy-, (3.alpha.,5.beta.,7.alpha.)-, NSC657949, NCGC00016387-02, CAS-474-25-9, JN3, (+)-chenodeoxycholate, Prestwick0_000285, Prestwick1_000285, Prestwick2_000285, Prestwick3_000285, Spectrum5_002009, CHENIX (TN), (3|A,5|A,7|A)-3,7-Dihydroxycholan-24-oic Acid, (+)-chenodeoxycholic acid, bmse000908, D03ZTE, D0Y1RT, 7a-Hydroxy-desoxycholsaeure, EC 207-481-8, AC1L1UK8, BIDD:PXR0056, Chenodeoxycholic acid [INN], SCHEMBL25055, BSPBio_000190, GTPL608, MLS002154253, 3a,7a-dihydroxy-5b-cholanate, SPBio_002409, BPBio1_000210, CHEMBL240597, Chenodeoxycholic acid, >=97%, DTXSID2020260, 7.alpha.-Hydroxylithocholic acid, BDBM21674, MolPort-001-794-647, 3a,7a-dihydroxy-5b-cholanic acid, HMS1568J12, HMS2095J12, HMS2234I22, HMS3712J12, Chenodeoxycholic acid (JP16/INN), Chenodeoxycholic acid (JP17/INN), ZINC3914808, Tox21_110412, Tox21_200491, 3a,7a-dihydroxy-5b-cholan-24-oate, HSCI1_000210, LMST04010032, SBB002935, AKOS024280614, CCG-220285, CS-0834, DB06777, LS-7259, MCULE-3421183878, SMP1_000064, 3.alpha.,7.alpha.-Dihydroxycholansaeure, 3a,7a-dihydroxy-5b,14a,17b-cholanate, 3a,7a-dihydroxy-5b-cholan-24-oic acid, NCGC00142400-03, NCGC00142400-04, NCGC00258045-01, 3.alpha.,7.alpha.-Dihydroxycholanic acid, AN-23481, AS-13636, HY-76847, SMR000857194, ST033520, AB2000327, TR-017501, 3a,7a-dihydroxy-5b,14a,17b-cholanic acid, AB00513822, S1843, (3a,5b,7a)-3,7-dihydroxy-cholan-24-oate, 3alpha, 7alpha-dihydroxy-5beta-cholanoic acid, 3alpha, 7alpha,-dihydroxy-5beta-cholanic acid, C-2900, C02528, D00163, J10019, W-5059, (3a,5b,7a)-3,7-dihydroxy-cholan-24-oic acid, 25795-EP2289883A1, 25795-EP2295411A1, 25795-EP2315303A1, AB00513822-06, AB00513822_07, Chenodiol;Chenodesoxycholic acid;Chenocholic acid, 3.alpha.,7.alpha.-Dihydroxy-5.beta.-cholanic acid, Dihydroxy-3.alpha.,7.alpha.(5.beta.)Cholanic acid, 3.alpha.,7.alpha.-Dihydroxy-5.beta.-cholanoic acid, BRD-K18135438-001-16-7, 0DBBBC66-0CFA-4DB9-97F4-5B1492756A02, Z1270387252, 3.alpha.,7.alpha.-Dihydroxy-5.beta.-cholan-24-oic acid, UNII-JIY1ILR284 component RUDATBOHQWOJDD-BSWAIDMHSA-N, 5.beta.-Cholan-24-oic acid, 3.alpha.,7.alpha.-dihydroxy-, 3,7-Dihydroxycholan-24-oic acid, (3.alpha.,5.beta.,7.alpha.)- #, Chenodeoxycholic acid, 500 mug/mL in methanol, certified reference material, Chenodeoxycholic acid, European Pharmacopoeia (EP) Reference Standard, Cholan-24-oic acid, 3,7-dihydroxy-, (3-.alpha., 5-.beta., 7-.alpha.)-, (4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0(2),.0(1)(1),(1)]heptadecan-14-yl]pentanoic acid, (4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0?,?.0??,??]heptadecan-14-yl]pentanoic acid


ID: 2022

chemical graph of compound 2022



InChIKey: RUDATBOHQWOJDD-UZVSRGJWSA-N
SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 31401
synonyms found at PubChem are:
URSODEOXYCHOLIC ACID, ursodiol, 128-13-2, Actigall, Ursofalk, Ursolvan, Delursan, ursodeoxycholate, UDCA, UrSO, Urso Forte, Ursodesoxycholic acid, Destolit, Ursochol, Cholit-ursan, Litursol, Solutrat, Ursobilin, Ursodamor, Arsacol, Deursil, Lyeton, Ursacol, Peptarom, Urso DS, 3alpha,7beta-Dihydroxy-5beta-cholan-24-oic acid, Ursosan, UDCS, Ursacholic Acid, Ursodexycholic Acid, Urso 250, Deoxyursocholic Acid, Acido ursodeoxicolico, Antigall, Urosiol, Acido ursodeossicolico, 3-alpha,7-beta-Dioxycholanic acid, Acide ursodesoxycholique, Acidum ursodeoxycholicum, 7-beta-Hydroxylithocholic acid, Ursocholic acid, deoxy-, 3-alpha,7-beta-Dihydroxycholanic acid, Acido ursodeossicolico [Italian], Ursodiol [USAN], Acido ursodeoxicolico [INN-Spanish], Acidum ursodeoxycholicum [INN-Latin], Acide ursodesoxycholique [INN-French], ISO-URSODEOXYCHOLIC ACID, NSC 683769, 3-alpha,7-beta-Dihydroxy-5-beta-cholanoic acid, Dom-ursodiol c, PHL-ursodiol c, PMS-ursodiol c, Ursodeoxycholicacid, (3alpha,5beta,7beta)-3,7-dihydroxycholan-24-oic acid, 7beta-Hydroxylithocholic acid, Actigall (TN), Ursodiol (USP), NSC 657950, UNII-724L30Y2QR, BRN 3219888, 3,7-Dihydroxycholan-24-oic acid, CCRIS 5502, Urso (TN), EINECS 204-879-3, CHEMBL1551, Ursodesoxycholic acid (UDCA), MLS000028461, CHEBI:9907, 5beta-Cholan-24-oic acid-3alpha,7beta-diol, RUDATBOHQWOJDD-UZVSRGJWSA-N, 17-beta-(1-Methyl-3-carboxypropyl)etiocholane-3-alpha,7-beta-diol, 724L30Y2QR, 3 alpha,7 beta-Dihydroxy-5 beta-cholan-24-oic Acid, (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid, 5beta-Cholanic Acid-3alpha,7beta-diol, SMR000058403, Cholan-24-oic acid, 3,7-dihydroxy-, (3alpha,5beta,7beta)-, 3alpha,7beta-Dihydroxy-5beta-cholanic acid, U0030, U-9000, (R)-4-((3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, IU5, Cholan-24-oic acid, 3,7-dihydroxy-, (3a,5b,7b)-, 5-beta-Cholan-24-oic acid, 3-alpha,7-beta-dihydroxy-, (3alpha,5beta,7beta,8xi)-3,7-dihydroxycholan-24-oic acid, Ursodeoxy cholic acid, (4R)-4-[(1S,2S,5R,7S,9S,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid, SR-01000737091, Ursodiol [USAN:USP], 7 beta-Hydroxylithocholic acid, ursocol, Ursodexycholate, Paptarom, Udiliv, Desol, Urdes, Urosdesoxycholate, Ursodesoxycholicacid, CPD000058403, Ursodeoxycholoc acid, Deursil (TN), Ursosan (TN), Urosdesoxycholic acid, Urso Forte (TN), 5 beta-Cholan-24-oic acid-3alpha,7 beta-diol, AC1L1LJH, Ursodiol (Actigal Urso), 3alpha,7 beta-Dihydroxy-5 beta-cholan-24-oic acid, Prestwick0_000958, Prestwick1_000958, Prestwick2_000958, Prestwick3_000958, 7 -Hydroxylithocholic acid, D0G3SH, EC 204-879-3, Ursodeoxycholic acid [INN], SCHEMBL27200, BSPBio_000956, 4-10-00-01604 (Beilstein Handbook Reference), 7bet.-Hydroxylithocholic acid, cid_31401, MLS001066373, MLS002548885, SPBio_003105, Ursodeoxycholic acid, >=99%, BPBio1_001052, GTPL7104, 7.beta.-Hydroxylithocholic acid, Ursodiol (Ursodeoxycholic Acid), DTXSID6023731, BDBM53721, Ursodeoxycholic acid, 99% 1g, AOB5075, MolPort-001-794-630, HMS1570P18, HMS2097P18, HMS2233L14, HMS3259A13, HMS3714P18, Ursodeoxycholic acid (JP15/INN), Ursodeoxycholic acid (JP17/INN), 3alpha,7beta-dihydroxycholanic acid, ACT02676, ZINC3914809, 3a,7b-dihydroxy-5b-cholan-24-oate, Cholan-24-oic acid, 3,7-dihydroxy-, (3.alpha.,5.beta.,7.beta.)-, LMST04010033, MFCD00003680, s1643, AKOS015955898, API0004557, CCG-220958, CS-1932, DB01586, KS-5243, MCULE-4374611501, NC00487, 5 -Cholan-24-oic acid-3 ,7 -diol, SMP2_000012, 3.alpha.,7.beta.-Dihydroxycholanic acid, 3a,7b-dihydroxy-5b-cholan-24-oic acid, NCGC00179363-01, AC-18919, CAS#128-13-2, CC-35557, HY-13771, LS-53033, NCI60_028904, 3 ,7 -Dihydroxy-5 -holan-24-oic acid, AB2000188, KB-276923, AB00513977, ST24050336, (3a,5b,7b)-3,7-dihydroxy-cholan-24-oate, 3alpha, 7beta-dihydroxy-5beta-cholanoic acid, 5bet.-Cholan-24-oic acid-3alp.,7bet.-diol, (3a,5b,7b)-3,7-dihydroxycholan-24-oic acid, A-7799, C07880, D00734, J10139, (3a,5b,7b)-3,7-dihydroxy-cholan-24-oic acid, AB00513977-09, AB00513977_10, 3alp.,7bet.-Dihydroxy-5bet.-cholan-24-oic acid, C-21580, 3.alpha.,7.beta.-Dihydroxy-5.beta.-cholanic acid, J-005566, J-650210, SR-01000737091-3, SR-01000737091-4, BRD-K15697815-001-16-2, 3.alpha.,7.beta.-Dihydroxy-5.beta.-cholan-24-oic acid, Z2786051717, 5.beta.-Cholan-24-oic acid, 3.alpha.,7.beta.-dihydroxy-, Ursodiol, United States Pharmacopeia (USP) Reference Standard, Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-beta)-, Ursodeoxycholic acid, British Pharmacopoeia (BP) Reference Standard, Ursodeoxycholic acid, European Pharmacopoeia (EP) Reference Standard, 17.beta.-(1-Methyl-3-carboxypropyl)etiocholane-3.alpha.,7.beta.-diol, 3,7-Dihydroxycholan-24-oic acid-, (3.alpha.,5.beta.,7.beta.)- #, Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-beta)- (9CI), Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-beta)-(9CI), Ursodeoxycholic acid, 500 mug/mL in methanol, certified reference material, Ursodiol, Pharmaceutical Secondary Standard; Certified Reference Material, Ursodeoxycholic acid for system suitability, European Pharmacopoeia (EP) Reference Standard, Ursodeoxycholic acid, UDCA, Ursosan, Ursofalk, Urso Forte, Udiliv, Ursodiol, (4R)-4-[(1S,2S,5R,7S,9S,10R,11S,14R,15R)-5,9-Dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,1.011,1]heptadecan-14-yl]pentanoic acid, (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-bis(oxidanyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid, (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid, 50809-41-1, 80225-86-1


ID: 2023

chemical graph of compound 2023



InChIKey: RUVINXPYWBROJD-ONEGZZNKSA-N
SMILES: C/C=C/C1=CC=C(C=C1)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 637563
synonyms found at PubChem are:
ANETHOLE, trans-Anethole, 4180-23-8, 104-46-1, (E)-Anethole, 4-Propenylanisole, Anise camphor, Isoestragole, (E)-1-Methoxy-4-(prop-1-en-1-yl)benzene, Anethol, trans-Anethol, p-Anethole, Oil of aniseed, p-Propenylanisole, (E)-Anethol, Aniskampfer, Monasirup, trans-p-Propenylanisole, (E)-p-Propenylanisole, p-1-Propenylanisole, (E)-1-(4-Methoxyphenyl)propene, 1-Methoxy-4-(prop-1-en-1-yl)benzene, Nauli gum, trans-4-(1-Propenyl)anisole, trans-p-Anethole, (E)-1-Methoxy-4-(1-propenyl)benzene, 1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene, trans-p-Methoxy-beta-methylstyrene, 1-Methoxy-4-(1-propenyl)benzene, cis-Anethol, Propene, 1-(p-methoxyphenyl)-, t-anethole, 1-methoxy-4-[(E)-prop-1-enyl]benzene, trans-Anethole (natural), UNII-Q3JEK5DO4K, Anethole, trans-, 1-Propene, 1-(4-methoxyphenyl)-, Propenylanisole, p-, (E)-, (E)-1-p-Methoxyphenylpropene, Anisole, p-propenyl-, Anisole, p-propenyl-, trans-, 1-Methoxy-4-propenylbenzene, FEMA No. 2086, trans-1-Methoxy-4-(1-propenyl)benzene, Anisole, p-propenyl-, (E)-, CCRIS 2481, 4-Methoxypropenylbenzene, Benzene, 1-methoxy-4-(1E)-1-propenyl-, 1-p-Methoxyphenylpropene, trans-, Benzene, 1-methoxy-4-(1-propenyl)-, (E)-, EINECS 224-052-0, Methoxy-beta-methylstyrene, trans-p-, Q3JEK5DO4K, 4-Methoxy-1-propenylbenzene, trans-1-(p-Methoxyphenyl)-1-propene, trans-1-(4-Methoxyphenyl)-1-propene, NSC 209529, p-Propenylphenyl methyl ether, BRN 0636190, 1-Methoxy-4-((1E)-1-propenyl)benzene, Benzene, 1-methoxy-4-(1-propenyl)-, 1-Methoxy-4-(1-propenyl)benzene, (E)-, trans-1-p-Anisylpropene, p-Methoxy-.beta.-methylstyrene, Acintene O, CHEBI:35616, NSC4018, Anethole (NF), Anethole [NF], Anethol (synthetic), Caswell No. 051B, p-Propenylmethoxybenzene, DSSTox_CID_87, FEMA Number 2086, NSC 4018, Methoxy-4-propenylbenzene, p-Methoxy-beta-methylstyrene, DSSTox_RID_75356, DSSTox_GSID_20087, 1-(methyloxy)-4-[(1E)-prop-1-en-1-yl]benzene, E-anethole, CCRIS 6211, HSDB 1427, trans-Anise camphor, Benzene, 1-methoxy-4-(propenyl)-, EINECS 203-205-5, Anethole, trans, 1-(4-Methoxyphenyl)-1(3)-propene, Nauli ''gum'', EPA Pesticide Chemical Code 015604, BRN 0774229, (E)-1-methoxy-4-(prop-1-enyl)benzene, p-(1-Propenyl)anisole, Anethole [USAN], 4-(1-propenyl)anisole, CAS-4180-23-8, AI3-00380, Benzene, 1-methoxy-4-(1-propen-1-yl)-, 1-(p-Methoxyphenyl)propene, SR-05000001866, 4-06-00-03796 (Beilstein Handbook Reference), CHEBI:2716, trans-1-(p-Methoxyphenyl)propene, isoestragol>, 1-Methoxy-4-[1-propenyl]benzene #, anethole-trithione, Anisole, trans-, p-propenylanisol>, Nauli 'gum', 50770-19-9, EINECS 256-753-2, AC1LCUHK, Benzene, 1-methoxy-4-(1E)-1-propen-1-yl-, trans-Anethole, 99%, para-methoxyphenylpropene', Spectrum5_000727, EC 224-052-0, ghl.PD_Mitscher_leg0.12, SCHEMBL48599, BSPBio_002818, trans-p-Methoxypropenylbenzene, 2-06-00-00523 (Beilstein Handbook Reference), SPECTRUM1503705, WLN: 2U1R DO1, Anethol, natural, 99%, FG, AC1Q56Q9, CHEMBL452630, Jsp000441, DTXSID9020087, WLN: 2U1R DO1 -T, MolPort-002-507-189, MolPort-004-288-385, RUVINXPYWBROJD-ONEGZZNKSA-N, HMS1922I20, HMS2089P20, HMS2093I09, Pharmakon1600-01503705, ZINC967630, trans-Anethole, analytical standard, HY-B0900, NSC-4018, Tox21_202282, Tox21_300132, BBL027751, CCG-38720, MFCD00009284, NSC209529, NSC758626, STK801277, trans-p-Methoxy-.beta.-methylstyrene, trans-Anethole, >=99%, FCC, FG, AKOS000121299, DS-2756, LS-2410, NE10646, NSC-209529, NSC-758626, RTR-030614, 1-((1E)prop-1-enyl)-4-methoxybenzene, methyl 4-(prop-1-en-1-yl)phenyl ether, NCGC00091493-02, NCGC00091493-03, NCGC00091493-04, NCGC00091493-05, NCGC00091493-06, NCGC00091493-07, NCGC00254015-01, NCGC00259831-01, AJ-24537, AN-18858, CJ-04629, KB-81234, SC-47202, ZB015469, SBI-0052758.P002, trans-Anethole, purum, >=98.0% (GC), KB-219117, ST2408089, TC-138812, TR-030614, trans''-1-methoxy-4-(prop-1-enyl)benzene, Benzene,1-Methoxy-4-(1-Propenyl)-,(E)-, P0494, ST50330583, X8716, Z4733, C10428, D02377, AB00053256-02, AB00053256_03, Q-201853, SR-05000001866-1, SR-05000001866-2, W-108812, BRD-K49060658-001-01-5, I14-111054, trans-Anethole, primary pharmaceutical reference standard, UNII-A79C64YD3Q component RUVINXPYWBROJD-ONEGZZNKSA-N, Anethole, United States Pharmacopeia (USP) Reference Standard, BENZENE,1-METHOXY,4-PROPENYL(TRANS) TRANS ANETHOL, InChI=1/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3, trans-Anethole, Pharmaceutical Secondary Standard; Certified Reference Material, 109957-71-3, 12002-40-3, 57131-42-7, 8022-08-0


ID: 2024

chemical graph of compound 2024



InChIKey: RVFUNJWWXKCWNS-UHFFFAOYSA-N
SMILES: CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 23659
synonyms found at PubChem are:
Metoclopramide hydrochloride, 7232-21-5, Maxolon, Metoclopramide monohydrochloride, METOCLOPRAMIDE HCL, Rimetin, Primperan (tablet), Cerucal, Paspertin, Metoclopramide Intensol, UNII-7B1QZY5SWZ, Metozolv, CCRIS 7142, EINECS 230-634-5, 7B1QZY5SWZ, NSC 354467, C14H22ClN3O2.HCl, AHR-3070-C, MLS000069667, 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide hydrochloride, Metoclopramide hydrochloride anhydrous, SMR000058471, 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-o-anisamide hydrochloride, Metoclopramide monohydrochloride monohydrate, 4-Amino-5-Chloro-N-(2-(Diethylamino)Ethyl)-N-Anisamide, 4-amino-5-chloro-N-(2-diethylaminoethyl)-2-methoxybenzamide hydrochloride, Metozolv ODT, o-Anisamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-, monohydrochloride, 364-62-5 (Parent), Reglan ODT, 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide monohydrochloride, SR-01000000165, C14H22ClN3O2.ClH, 4-Amino-5-chloro-N-[2-(diethylamino)ethyl]-o-anisamide hydrochloride, (4-amino-5-chloro-2-methoxyphenyl)-N-[2-(diethylamino)ethyl]carboxamide, chlor ide, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxy-benzamide hydrochloride, Prestwick_332, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide;hydrochloride, Metoclopramide hydrochloride [USAN:JAN], Benzamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxy-, monohydrochloride, monohydrate, Opera_ID_1671, AC1L2MT3, AC1Q3LU2, MLS001074186, MLS002222202, o-Anisamide, monohydrochloride, SCHEMBL205200, SPECTRUM1500410, CHEMBL1256771, CTK8G1096, MolPort-003-666-233, HMS1568J19, HMS1920N15, Metoclopramide hydrochloride, solid, Pharmakon1600-01500410, BCP28471, KS-000018AM, Tox21_500762, 2542AH, BG0253, MFCD00058011, MFCD00150634, NSC354467, NSC757117, SBB058161, AKOS015889947, API0003351, API0006827, CCG-212697, HS-0006, LP00762, MCULE-8548227068, NC00519, NSC-354467, NSC-757117, Benzamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxy-, monohydrochloride, Metoclopramide Hydrochloride (anhydrous), NCGC00094102-01, NCGC00094102-02, NCGC00094102-03, NCGC00094102-04, NCGC00094102-05, NCGC00261447-01, AN-16617, AN-40630, CPD000058471, H780, LS-20040, SAM002554911, WLN: 2N2&2MVR DZ CG FO1 &GH, AB1009373, AX8140039, KB-240082, KB-304048, LS-175536, EU-0100762, FT-0657870, FT-0672375, S4289, ST24028881, ST51015042, VU0239518-5, J10269, M 0763, I01-4517, SR-01000000165-2, SR-01000000165-7, 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamidehydrochloride, Benzamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxy-, monohydrochloride (9CI), Benzamide, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxy-, hydrochloride (1:1), 49625-23-2, Metoclopramide Base, AC1LCWGG, AKOS015890642, A823256, I01-7044, 4-amino-5-chloro-N-(2-diethylaminoethyl)-2-methoxy-benzamide, 4-amino-5-chloro-N-(2-diethylaminoethyl)-2-methoxybenzamide; hydron; chloride, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide; hydron; chloride, 4-azanyl-5-chloranyl-N-[2-(diethylamino)ethyl]-2-methoxy-benzamide; hydron; chloride


ID: 2025

chemical graph of compound 2025



InChIKey: RVIUMPLAOXSSGN-UHFFFAOYSA-N
SMILES: CC(C)CN(C)C1=NC(=C(N=C1Cl)C(=O)N=C(N)N)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 73314
synonyms found at PubChem are:
5-(N-Methyl-N-isobutyl)amiloride, 96861-65-3, Methylisobutylamiloride, 5-Nmnia, AC1Q3POP, Lopac-A-5585, AC1L2JN1, Lopac0_000048, MLS002153509, SCHEMBL2432777, SCHEMBL9852472, CHEMBL1256180, CTK8F6555, DTXSID50242594, ZINC4467875, 5-(N-Methyl-N-isobutyl)??amiloride, CCG-204144, 3-amino-6-chloro-n-(diaminomethylene)-5-[isobutyl(methyl)amino]pyrazine-2-carboxamide, NCGC00015068-01, NCGC00015068-02, NCGC00015068-03, NCGC00015068-04, NCGC00093562-01, NCGC00093562-02, SMR001230841, EU-0100048, A 5585, SR-01000075678, SR-01000075678-1, 3-amino-6-chloro-N-(diaminomethylidene)-5-[methyl(2-methylpr, 5-(N-Methyl-N-isobutyl)??amiloride, >=98% (TLC), powder, 3-Amino-5-(N-methyl-N-isobutylamino)-N-(aminoiminomethyl)-6-chloropyrazinecarboxamide, 3-amino-N-carbamimidoyl-6-chloro-5-[isobutyl(methyl)amino]pyrazine-2-carboxamide, Pyrazinecarboxamide, 3-amino-N-(aminoiminomethyl)-6-chloro-5-(methyl(2-methylpropyl)amino)-, 3-amino-6-chloro-N-(diaminomethylidene)-5-[methyl(2-methylpropyl)amino]pyrazine-2-carboxamide


ID: 2026

chemical graph of compound 2026



InChIKey: RVMGXWBCQGAWBR-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=O)C=C(O2)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2741
synonyms found at PubChem are:
chromocarb, 4940-39-0, Chromone-2-carboxylic acid, 4-Oxo-4H-chromene-2-carboxylic acid, 4-Oxo-4H-1-benzopyran-2-carboxylic acid, Atremon, 4-Oxochromene-2-carboxylic acid, Chromonecarboxylic acid, LP-1, Chromocarb [INN:DCF], 2-Chromonecarboxylic Acid, Chromocarbe [INN-French], Chromocarbum [INN-Latin], Cromocarbo [INN-Spanish], 4H-1-BENZOPYRAN-2-CARBOXYLIC ACID, 4-OXO-, Campel, UNII-FY38S0790W, EINECS 225-583-0, BRN 0146442, CHEMBL83628, 4H-1-Benzopyran-2-carboxylicacid, 4-oxo-, RVMGXWBCQGAWBR-UHFFFAOYSA-N, FY38S0790W, NCGC00094989-01, DSSTox_CID_25878, DSSTox_RID_81194, DSSTox_GSID_45878, Chromocarbe, Chromocarbum, Cromocarbo, SMR000685795, CAS-4940-39-0, Chromocarb (INN), PubChem9709, Chromone-2-carboxylic acid (4-Oxo-4H-1-benzopyran-2-carboxylic acid), Fludarene (Salt/Mix), Angiophtal (Salt/Mix), Spectrum3_000708, Spectrum4_000953, ACMC-1APW2, AC1L1ED2, Oprea1_123976, BSPBio_002495, KBioGR_001566, MLS000881205, MLS000881215, DivK1c_000471, SCHEMBL432304, SPECTRUM1503044, AC1Q72Y0, AC1Q72Y1, DTXSID6045878, CTK1D6380, HMS501H13, KBio1_000471, KBio3_001715, KS-00000CHY, ZINC57734, CHEBI:113552, MolPort-000-499-561, NINDS_000471, HMS1922A15, HMS2966O18, HMS3652D13, Pharmakon1600-01503044, ACN-S004166, HY-B1182, 4-Oxo4H-chromene-2-carboxylic acid, Tox21_111376, ANW-30767, BBL011801, BDBM50131079, CC-822, MFCD00006838, NSC758218, s4208, SBB003660, STK727279, 4-oxo-1-benzopyran-2-carboxylic acid, AKOS000119396, Tox21_111376_1, AC-7283, AN-9165, CCG-213852, Chromocarb; Chromone-2-carboxylic acid, CS-4791, MCULE-9387531298, NSC-758218, RTR-017797, IDI1_000471, 4-Oxo-4H-chromene-2-carboxylic acid #, NCGC00094989-02, NCGC00094989-03, NCGC00094989-04, NCGC00178630-01, 4-Oxo-4H-1-benzopyran-2-carboxylicAcid, AJ-09782, AS-15657, BR-73072, KB-48910, LS-39223, Q157, SY005480, SBI-0051754.P002, AB0017434, AB1003140, DB-051627, TR-017797, AM20060637, FT-0623799, O0290, ST24032829, ST50146730, EN300-17343, D07695, S-2494, 4-Oxo-4H-1-benzopyran-2-carboxylic acid, 97%, AB00052303_07, AB00052303_08, 940C390, SR-01000781903, SR-01000781903-2, W-106024, BRD-K94720315-001-01-3, BRD-K94720315-001-05-4, Z56922101, F0850-6795, 72275-48-0, AO7, ethyl 2-{[({4-methyl-5-[1-methyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}thio)acetyl]amino}benzoate


ID: 2027

chemical graph of compound 2027



InChIKey: RWCVSDKDFSVZNF-KRYGIPSASA-N
SMILES: CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 159908
synonyms found at PubChem are:
Rutilantinone, Epsilon-pyrromycinone, Rutilantinon, Eta-Pyrromycinon, Antibiotic MA 144D2, PYRROMYCINONE, EPSILON, 21288-61-9, MA 144D2, NSC 114778, .epsilon.-Pyrromycinone, 1-Naphthacenecarboxylic acid, 1,2,3,4,6,11-hexahydro-2-ethyl-2,4,5,7,10-pentahydroxy-6,11-dioxo-, methyl ester, (1R,2R,4S)-, epsilon-pyrromy-cinone, Spectrum_000795, AC1L4MPH, Spectrum2_000452, Spectrum3_001155, Spectrum4_001432, Spectrum5_000284, BSPBio_002709, KBioGR_001904, KBioSS_001275, SPECTRUM201606, SPBio_000524, CHEMBL3039086, CTK4E6366, KBio2_001275, KBio2_003843, KBio2_006411, KBio3_002209, CHEBI:108590, RWCVSDKDFSVZNF-KRYGIPSASA-N, HMS1923A07, CCG-38694, SDCCGMLS-0066382.P001, NCGC00178516-01, LS-93964, SR-05000002666, SR-05000002666-1, BRD-K11258719-001-03-2, 1-Naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,4,5,7,10-pentahydroxy-6,11-dioxo-, methyl ester, (1R,2R,4S)-, 1-Naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,4,5,7,10-pentahydroxy-6,11-dioxo-, methyl ester, (1R,2R,4S)- (8CI), 1-Naphthacenecarboxylicacid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,4,5,7,10-pentahydroxy-6,11-dioxo-,methyl ester, (1R,2R,4S)-, methyl (1R,2R,4S)-2-ethyl-2,4,5,7,10-pentahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate


ID: 2028

chemical graph of compound 2028



InChIKey: RWQKHEORZBHNRI-BMIGLBTASA-N
SMILES: C[C@@H]1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 442530
synonyms found at PubChem are:
OCHRATOXIN A, 303-47-9, Antibiotic 9663, Phenylalanine - ochratoxin A, 3R14S-Ochratoxin A, NCI-C56586, C20H18ClNO6, CHEBI:7719, RWQKHEORZBHNRI-BMIGLBTASA-N, Ochratoxin A, aspergillus ochraceus, Ochratoxin A-BSA conjugate from Aspergillus ochraceus, (-)-N-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-3-phenylalanine, N-(((3R)-5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-3-phenyl-L-alanine, NSC 201422, UNII-1779SX6LUY, L-Phenylalanine, N-((5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl)-, (R)-, N-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-isochromen-7-yl]carbonyl}-L-phenylalanine, OTA, CCRIS 2382, HSDB 4305, EINECS 206-143-7, Alanine, N-((5-chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-3-phenyl-, (-)-, BRN 1301486, N-[(3R)-(5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl]-L-phenylalanine, (2S)-2-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl]formamido}-3-phenylpropanoic acid, 1779SX6LUY, Alanine, N-[(5-chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl]-3-phenyl-, (-)-, (R)-N-((5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1 H-2-benzopyran-7-yl)carbonyl)phenylalanine, (R)-N-((5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-benzo(c)pyran-7-yl)carbonyl)-3-phenylalanine, L-Phenylalanine, N-[(5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl]-, (R)-, Ochratoxin A(OTA), Ochratoxin A solution, D08UIB, D0KN6Q, AC1L9D0T, CBiol_002012, SCHEMBL15105, CHEMBL589366, GTPL4672, MEGxm0_000357, DTXSID7021073, ACon0_000200, ACon1_001268, BIO1001, MolPort-001-739-782, ZX-AFC000190, ZX-AFC000204, Bio1_000298, Bio1_000787, Bio1_001276, N-[[(3R)-5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-L-phenylalanine, ZINC3861782, MFCD00078079, AKOS024456512, LS-1157, MCULE-3363875457, SMP2_000132, NCGC00162403-01, NCGC00162403-02, NCGC00162403-03, NCGC00162403-04, NCGC00162403-05, ST50826330, C09955, J-017922, BRD-K39944607-001-01-4, Ochratoxin A, from Petromyces albertensis, >=98% (HPLC), Ochratoxin A, reference material, from Aspergillus ochraceus, Ochratoxin A, purum, >=98.0% (TLC), from Aspergillus ochraceus, Ochratoxin A solution, 10 mug/mL in acetonitrile, analytical standard, (-)-N-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl-3-phenylalanine, (-)-N- [(5-Chloro- 8-hydroxy- 3-methyl- 1-oxo- 7-isochromanyl) carbonyl]- 3-phenylalanine, (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid, (2S)-2-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl]amino}-3-phenylpropanoic acid, (R)-N- [(5-Chloro- 3,4-dihydro- 8-hydroxy- 3-methyl- 1-oxo- 1H-2-benzopyran-7-yl) -carbonyl]- L- phenylalanine, (R)-N-((5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)-carbonyl)-L-phenylalanine, (R)-N-((5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl)phenylalanine, (S)-2-((R)-5-chloro-8-hydroxy-3-methyl-1-oxoisochroman-7-carboxamido)-3-phenylpropanoic acid, 2-[((3R)-5-chloro-8-hydroxy-3-methyl-1-oxoisochroman-7-yl)carbonylamino](2S)-3 -phenylpropanoic acid, InChI=1/C20H18ClNO6/c1-10-7-12-14(21)9-13(17(23)16(12)20(27)28-10)18(24)22-15(19(25)26)8-11-5-3-2-4-6-11/h2-6,9-10,15,23H,7-8H2,1H3,(H,22,24)(H,25,26, N-[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl]-L-phenylalanine, N-[(5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl]phenylalanine, 9CI, N-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl]carbonyl}-L-phenylalanine, NCGC00162403-05_C20H18ClNO6_L-Phenylalanine, N-[[(3R)-5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-, Ochratoxin A solution, certified reference material, 50 mug/mL in benzene: acetic acid (99:1), ampule of 1 mL


ID: 2029

chemical graph of compound 2029



InChIKey: RWSXRVCMGQZWBV-WDSKDSINSA-N
SMILES: C(CC(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C(=O)O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 124886
synonyms found at PubChem are:
glutathione, 70-18-8, L-Glutathione, Glutathion, Isethion, Tathion, Glutathione-SH, Glutinal, reduced glutathione, Deltathione, Neuthion, Copren, L-Glutathione reduced, Glutide, Tathione, Triptide, Ledac, Glutatione, GSH, Glutatiol, Panaron, Glutathione SH, L-Glutatione, Agifutol S, Glutathione (reduced), gamma-L-Glutamyl-L-cysteinylglycine, gamma-L-glutamyl-L-cysteinyl-glycine, 5-L-Glutamyl-L-cysteinylglycine, Glutathione [JAN], L-gamma-glutamyl-L-cysteinylglycine, gamma-L-Glutamylcysteinylglycine, glutathione red, red. glutathione, Bakezyme RX, UNII-GAN16C9B8O, (S)-2-Amino-5-(((R)-1-((carboxymethyl)amino)-3-mercapto-1-oxopropan-2-yl)amino)-5-oxopentanoic acid, L-Glutathione reduce, Glycine, L-gamma-glutamyl-L-cysteinyl-, CCRIS 2094, N-(N-gamma-L-Glutamyl-L-cysteinyl)glycine, N-(N-L-gamma-Glutamyl-L-cysteinyl)glycine, L-Glutathione, reduced, glutathione reduced, glycine, N-(N-L-gamma-glutamyl-L-cysteinyl)-, EINECS 200-725-4, NSC 400639, GAN16C9B8O, L-glutamyl-L-cysteinylglycine, CHEBI:16856, RWSXRVCMGQZWBV-WDSKDSINSA-N, (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid, DSSTox_CID_3101, DSSTox_RID_76875, DSSTox_GSID_23101, [Glu(-Cys)]n-Gly, phytochelatins, Phytochelatin, (2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-sulfanylethyl]carbamoyl}butanoic acid, CAS-70-18-8, (S)-2-Amino-5-((R)-1-(carboxymethylamino)-3-mercapto-1-oxopropan-2-ylamino)-5-oxopentanoic acid, Glycine, L-.gamma.-glutamyl-L-cysteinyl-, SR-05000002567, Glutathione [BAN:JAN], ReadiSorb, Glutathione;, NSC400639, 1lbk, NCGC00094976-01, Tathion (TN), GLUTHATHIONE, Glutathione (JP17), PubChem20020, Spectrum_000419, 1oe7, 1oe8, 1r4w, C(N-.gamma.Glu-)G, Reduced Glutathione,(S), Spectrum2_001500, Spectrum3_000946, Spectrum4_001056, Spectrum5_000940, Glutathione, Reduced Form, bmse000185, bmse000952, bmse000956, D02HFD, Glutathione (Reduced type), AC1L3Z9S, Cys(N-.gamma.Glu-)-Gly, SCHEMBL9167, CHEMBL1543, KBioGR_001352, KBioSS_000899, KSC377E2T, MLS001333069, DivK1c_000075, SPECTRUM1502248, SPBio_001519, GTPL6737, DTXSID6023101, L-?-glutamyl-L-cysteinylglycine, L-Glutathione reduced, 97.0%, CHEBI:60836, CTK2H7229, HMS500D17, KBio1_000075, KBio2_000899, KBio2_003467, KBio2_006035, KBio3_002012, KS-00000GCC, (gamma-Glutamylcysteine)n-glycine, L-g-glutamyl-L-cysteinyl-glycine, L-?-glutamyl-L-cysteinyl-glycine, MolPort-000-003-913, NINDS_000075, HMS1921N22, Pharmakon1600-01502248, Poly(gamma-glutamylcysteine)glycine, HY-D0187, L-Glutathione reduced, >=98.0%, ZINC3830891, gam.-L-Glutamyl-L-cysteinyl-glycine, Tox21_111371, ANW-43980, BDBM50422268, CCG-38876, L-gamma-glutamyl-L-cysteinyl-glycine, NSC758199, s4606, AKOS015999135, Tox21_111371_1, CS-7948, DB00143, MCULE-3371744018, NSC-758199, RP17794, SDCCGMLS-0066687.P001, .gamma.-L-Glutamyl-L-cysteinyl-glycine, IDI1_000075, N-(N-L-?-Glutamyl-L-cysteinyl)glycine, Pharm Biol 11: 539 (1968), SMP1_000247, NCGC00264046-02, AJ-45768, AK-48453, BC209606, DS-14675, LS-72665, SC-18300, SMR000857220, ST097777, SBI-0051743.P002, AB2000729, AX8132398, KB-296979, L-Glutathione reduced, BioXtra, >=98.0%, B7775, FT-0627837, G0074, ST24026560, 98726-08-0, Glycine, N-(N-L-gamma-glutamyl-L-cysteinyl), N-(N-L-.gamma.-Glutamyl-L-cysteinyl)glycine, C00051, C02471, D00014, G-3980, Y-8983, AB00443568_03, C-33528, SR-05000002567-1, SR-05000002567-2, L-Glutathione reduced, Vetec(TM) reagent grade, >=98%, Z2183947556, Glutathione, European Pharmacopoeia (EP) Reference Standard, Glutathione, United States Pharmacopeia (USP) Reference Standard, Glutathione, Pharmaceutical Secondary Standard; Certified Reference Material, L-Glutathione reduced, cell culture tested, BioReagent, >=98.0%, powder, N5-((R)-1-((carboxymethyl)amino)-3-mercapto-1-oxopropan-2-yl)-L-glutamine, (2S)-2-Amino-5-[[(2R)-1-(carboxymethylamino)-1-oxo- 3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid, 106272-20-2, 1109226-07-4, 4-(N-{(1R)-1-[N-(carboxymethyl)carbamoyl]-2-sulfanylethyl}carbamoyl)(2S)-2-ami nobutanoic acid, 95687-20-0


ID: 2030

chemical graph of compound 2030



InChIKey: RWTGFMPOODRXIM-UHFFFAOYSA-N
SMILES: C(CCN=C(N)N)CN=C(N)N.OS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 26968
synonyms found at PubChem are:
USAF A-5080, 1,4-Diguanidinobutane sulfate, Tetramethylene bis-guanidinium sulfate, 1,1'-Tetramethylenediguanidine sulfate (1:1), GUANIDINE, 1,1'-TETRAMETHYLENEDI-, SULFATE (1:1), 544-05-8 (Parent), MFCD00050545, AC1L1C95, LS-73905, Guanidine, N,N'''-1,4-butanediylbis-, sulfate (1:1) (9CI), [N'-[4-[[amino(azaniumyl)methylidene]amino]butyl]carbamimidoyl]azanium sulfate, Arcaine sulfate, 14923-17-2, 1,4-Diguanidinobutane, Arcaine sulfate salt, 36587-93-6, 1-(4-guanidinobutyl)guanidine sulfate, Guanidine, N,N'''-1,4-butanediylbis-, sulfate (1:1), NCGC00093576-02, Guanidine, N,N'''-1,4-butanediylbis-, sulfate, SR-01000075422, C6H16N6.H2O4S, EINECS 253-118-1, Prestwick_1059, 1,1'-Tetramethylenediguanidine sulphate, arcaine; sulfuric acid, ARCAINE SULPHATE, AC1L3O1W, DSSTox_CID_28664, DSSTox_RID_82934, DSSTox_GSID_48738, SPECTRUM1500706, SCHEMBL1999196, CHEMBL1256017, CTK1A9971, CTK8F7820, HMS501B17, DTXSID80872308, MolPort-044-723-519, RWTGFMPOODRXIM-UHFFFAOYSA-N, HMS1570P13, HMS2097P13, HMS3260M05, 1,4-Diguanidinobutane sulfate salt, Tox21_113186, Tox21_500062, 6152AH, CCG-38521, AKOS028109560, AKOS030228005, 1,1'-Tetramethylenediguanidine sulfate, LP00062, KS-000002E2, N-(4-Guanidino-butyl)-guanidine sulfate, NCGC00093576-01, NCGC00093576-03, NCGC00093576-04, NCGC00260747-01, 1,1-(Butane-1,4-diyl)diguanidine sulfate, CAS-36587-93-6, N,N'''-butane-1,4-diyldiguanidine sulfate, N,N'-1,4-Butanediylbis(guanidine) sulfate, 1,1'-(Butane-1,4-diyl)diguanidine sulfate, B6287, EU-0100062, FT-0622466, A 0384, K-4741, SR-01000075422-1, SR-01000075422-3, SR-01000075422-5, 2-[4-(diaminomethylideneamino)butyl]guanidine; sulfuric acid


ID: 2031

chemical graph of compound 2031



InChIKey: RWVIMCIPOAXUDG-UHFFFAOYSA-N
SMILES: C1=C2C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])NC(=O)C(=O)N2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3899541
synonyms found at PubChem are:
dnqx, 2379-57-9, 6,7-dinitro-1,4-dihydroquinoxaline-2,3-dione, FG 9041, FG-9041, UNII-62T278S1MX, 6,7-Dinitroquinoxaline-2,3-dione (DNQX), 2,3-Quinoxalinedione, 1,4-dihydro-6,7-dinitro-, 6,7-Dinitroquinoxaline-2,3(1H,4H)-dione, 6,7-Dinitro-1,4-dihydro-quinoxaline-2,3-dione, 62T278S1MX, SR-01000075442, 1ftl, Tocris-0189, AC1MZKE9, Lopac-D-0540, Biomol-NT_000182, D05KQC, Lopac0_000345, Oprea1_127694, MLS000705107, SCHEMBL594575, BPBio1_001176, C8H4N4O6, CHEMBL155265, SCHEMBL8128055, CHEBI:93492, CTK8F7031, DTXSID60178476, MolPort-003-846-931, 6,7-dinitro-2,3-quinoxalinediol, 6,7-dinitroquinoxaline-2,3-diol, HMS2599K21, HMS3261E11, HMS3266C03, DNQX, >=98% (TLC), Tox21_500345, BN0195, MFCD00069257, STL431184, STL507389, ZINC18118278, AKOS000448016, AKOS005066561, CCG-204440, CS-5935, DB03759, LP00345, MCULE-3076221110, NCGC00015319-01, NCGC00015319-02, NCGC00015319-03, NCGC00015319-04, NCGC00015319-05, NCGC00015319-06, NCGC00024490-01, NCGC00024490-02, NCGC00024490-03, NCGC00024490-04, NCGC00261030-01, BC600131, HY-15067, KB-76693, SMR000230466, ST044512, LS-143032, EU-0100345, FT-0620868, KS-00001876, D 0540, 1,4-Dihydro-6,7-Dinitro-2,3-Quinoxalinedione, AE-641/00586054, SR-01000313889, J-015214, SR-01000075442-1, SR-01000075442-3, SR-01000313889-1, BRD-K64400208-001-01-8, BRD-K64400208-001-02-6, BRD-K85266041-304-01-7


ID: 2032

chemical graph of compound 2032



InChIKey: RXBKMJIPNDOHFR-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)CCNN.OS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 61100
synonyms found at PubChem are:
Phenelzine sulfate, 156-51-4, PHENELZINE SULFATE SALT, Estinerval, Nardelzine, Kalgan, Phenethylhydrazin, Mao-Rem, Phenelzine bisulfate, Alacine, Phenelzine (sulfate), Alazin, Phenethylhydrazine sulfate, Phenelzine sulphate, Phenelzine hydrogen sulfate, Phenelzine bisulphate, Phenalzine dihydrogen sulfate, Phenelzine dihydrogen sulfate, Phenelzine acid sulfate, WL 7, Phenethylhydrazine sulphate, N-1544a, Phenylethylhydrazine sulfate, Phenylethylhydrazine sulphate, CCRIS 498, 2-Phenylethylhydrazine sulphate, 2-Phenylethylhydrazine dihydrogen sulfate, beta-Phenylethylhydrazine sulfate, (2-phenylethyl)hydrazine sulfate, Phenethylhydrazine sulfate (1:1), UNII-2681D7P965, EINECS 205-856-0, EP-411, S 1544, Phenelzine sulfate [USP], NSC 170957, Phenylethylhydrazine dihydrogen sulphate, Phenelzine hydrogen sulphate, 2-Phenylethylhydrazine hydrogen sulphate, 2-Phenylethylhydrazine dihydrogen sulphate, beta-Phenylethylhydrazine hydrogen sulphate, beta-Phenylethylhydrazine dihydrogen sulfate, CHEBI:8061, 1-Hydrazino-2-phenylethane hydrogen sulphate, Hydrazine, (2-phenylethyl)-, sulfate (1:1), P 1531, Hydrazine, (2-phenylethyl)-, sulfate, Hydrazine, phenethyl-, sulfate (1:1), 2681D7P965, DSSTox_CID_1144, Phenelzine sulfate (USP), DSSTox_RID_75973, DSSTox_GSID_21144, 2-phenylethylhydrazine;sulfuric acid, SMR000058500, SR-01000076074, Phenelzine sulfate [USAN], Felazine, Phelazin, Phenline, C8H12N2.H2O4S, Phenelzine(sulfate), Prestwick_595, Phenylaethyl-Hydrazin, W 1544A, AC1L1UIX, phenelzine; sulfuric acid, phenethyl hydrazine sulfate, SCHEMBL40652, 2-phenethyl-hydrazine sulfate, MLS000069778, MLS000758253, MLS001423996, SPECTRUM1500476, CHEMBL1200895, DTXSID3021144, phenethylhydrazine; sulfuric acid, 2-phenethylhydrazine sulfate salt, CTK8G2350, HMS500D04, HY-B1018A, MolPort-000-150-294, RXBKMJIPNDOHFR-UHFFFAOYSA-N, HMS1568B21, HMS1920J08, HMS2051I11, HMS2091N20, HMS2095B21, HMS2233N22, HMS3263C03, HMS3393I11, HMS3712B21, Pharmakon1600-01500476, .beta.-Phenylethylhydrazine sulfate, KS-00001FA3, Tox21_110236, Tox21_200134, Tox21_500971, CCG-40227, MFCD00050687, NSC170957, NSC757268, (2-phenylethyl)hydrazine sulfuric acid, AKOS015914085, Tox21_110236_1, API0003806, CS-4533, LP00971, LS-7653, MCULE-1121090101, NC00037, NSC-170957, NSC-757268, NCGC00015830-08, NCGC00094271-01, NCGC00094271-02, NCGC00094271-03, NCGC00094271-04, NCGC00094271-05, NCGC00257688-01, NCGC00261656-01, CPD000058500, FS000846, SAM001247037, EU-0100971, FT-0673678, .beta.-Phenylethylhydrazine dihydrogen sulfate, C07431, D00505, P 6777, J-009308, SR-01000076074-1, SR-01000076074-6, SR-01000076074-8, I14-44668, Phenelzine sulfate, United States Pharmacopeia (USP) Reference Standard, 75513-79-0, WLN: ZM2R & WSQQALACINEALAZINEEP-411ESTINERVALFENELSINFENETSINFENELZINAFENIZINKALGANMAO-REMMONOFENMONOPHENMONOTEN


ID: 2033

chemical graph of compound 2033



InChIKey: RXJXEVKNSVYHAS-UHFFFAOYSA-N
SMILES: CCOC1=CC=CC=C1NC2=NC(=CS2)C3=CC(=C(C=C3)OC)OC

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"N Pedemonte" "K Du" "GL Lukacs" "E Caci" "LJ Galietta" "AS Verkman" "O Zegarra-Moran"


CID is 2901912
synonyms found at PubChem are:
4-(3,4-dimethoxyphenyl)-N-(2-ethoxyphenyl)-1,3-thiazol-2-amine, AC1MEE05, Oprea1_076959, SCHEMBL837871, MolPort-002-207-231, ZINC4123323, AKOS001665688, MCULE-1836070818, EU-0078226, SR-01000492597, SR-01000492597-1


ID: 2034

chemical graph of compound 2034



InChIKey: RXKMOPXNWTYEHI-RDRKJGRWSA-N
SMILES: C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5282407
synonyms found at PubChem are:
Flunarizine dihydrochloride, 30484-77-6, flunarizine hydrochloride, Flunarizine 2HCl, Flunarizine HCl, Flunarizine diHCl, Flunarizine (dihydrochloride), UNII-C11102TO53, EINECS 250-216-6, Flunarizine hydrochloride [USAN:JAN], 1-(Bis(4-fluorophenyl)methyl)-4-cinnamylpiperazine dihydrochloride, KW-3149, R 14950, C11102TO53, (E)-1-(Bis-(p-fluorophenyl)methyl)-4-cinnamylpiperazine dihydrochloride, 1-[Bis(4-fluorophenyl)methyl]-4-(3-phenyl-2-propenyl)piperazine dihydrochloride, (E)-1-(Bis(4-fluorophenyl)methyl)-4-(3-phenyl-2-propenyl)piperazine dihydrochloride, R-14950, (E)-1-(Bis(4-fluorophenyl)methyl)-4-cinnamylpiperazine dihydrochloride, Piperazine, 1-(bis(p-fluorophenyl)methyl)-4-cinnamyl-, dihydrochloride, (E)-, 1-[bis(4-fluorophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine dihydrochloride, Piperazine, 1-(bis(4-fluorophenyl)methyl)-4-(3-phenyl-2-propenyl)-, dihydrochloride, (E)-, SR-01000000006, 27064-95-5, Flugeral, (E)-1-[Bis(4-fluorophenyl)methyl]-4-(3-phenyl-2-propenyl)piperazine dihydrochloride, 1-[bis(4-fluorophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine;dihydrochloride, Prestwick_222, EINECS 248-203-5, AC1NR00J, Flunarizine hydrochloride,(S), SPECTRUM1500993, C26H26F2N2.2HCl, C26H28Cl2F2N2, CHEMBL552659, SCHEMBL1009444, SCHEMBL1321708, CHEBI:31621, HY-B0358A, DTXSID80184554, 1-[bis (4-fluorophenyl)methyl]-4-(3-phenyl-2-propenyl)-piperazine dihydrochloride, MolPort-000-825-358, HMS1568P06, HMS1921O12, 52468-60-7 (Parent), BCP02932, Tox21_500527, CCG-39000, MFCD00058198, s2030, Flunarizine hydrochloride (JAN/USAN), AKOS015895373, AC-2152, BCP9000695, CS-2412, KS-5125, LP00527, NCGC00093920-01, NCGC00093920-02, NCGC00093920-03, NCGC00261212-01, AN-14275, BC201114, KB-51879, BCP0726000286, AB0012900, AB1009511, Flunarizine dihydrochloride, >=98% (TLC), LS-110458, EU-0100527, ST24047212, ST51015006, D01303, F 8257, K-7304, 484F776, A820398, C-22772, I06-0614, Q-100983, R 14,950, SR-01000000006-2, SR-01000000006-4, SR-01000000006-9, Flunarizine Dihydrochloride 1.0 mg/ml in Methanol (as free base), 1-[bis(4-fluorophenyl)methyl]-4-[(E)-cinnamyl]piperazine dihydrochloride, Flunarizine dihydrochloride, European Pharmacopoeia (EP) Reference Standard, 1-[bis(4-fluorophenyl)methyl]-4-(3-phenyl-2-propenyl)-piperazine dihydrochloride, 1-[bis(4-fluorophenyl)methyl]-4-(3-phenylprop-2-en-1-yl)piperazine dihydrochloride, 4-((2E)-3-phenylprop-2-enyl)-1-[bis(4-fluorophenyl)methyl]piperazine, chloride , chloride, Flunarizine dihydrochloride for system suitability, European Pharmacopoeia (EP) Reference Standard, AKOS026749953


ID: 2035

chemical graph of compound 2035



InChIKey: RXPRRQLKFXBCSJ-GIVPXCGWSA-N
SMILES: CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4[C@](C2)(C(=O)OC)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 15376
synonyms found at PubChem are:
vincamine, 1617-90-9, Pervincamine, Devincan, Minorine, Vincamidol, Monorin, Novicet, Methyl vincaminate, Arteriovinca, Vincasaunier, (+)-Vincamine, Anasclerol, Angiopac, Decincan, Devinkan, Tripervan, Vincadar, Vincafolina, Vincapront, Vinkametrin, Equipur, Oxygeron, Pervone, Vincafor, Perval, Ocu-vinc, Vincamina [DCIT], Vincimax, Vincamine base, Vincaminum [INN-Latin], UNII-996XVD0JHT, Vincamine [INN:BAN:DCF], Minorin, Vincachron, Vincagil, Vincamin, Vincapan, Vinca, Vinodrel retard, Vinca-Ecobi, Vinca-Minor, HSDB 7150, Anasclerol (base), EINECS 216-576-3, NSC 91998, 996XVD0JHT, CHEBI:9985, RXPRRQLKFXBCSJ-GIVPXCGWSA-N, Alkaloid obtained from Vinca minor, Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-, methyl ester, (3alpha,14beta,16alpha)-, 14,15-Dihydro-14-hydroxyeburnamenine-14-carboxylic acid methyl ester, DSSTox_CID_20134, DSSTox_RID_79448, Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-, methyl ester, (3alpha,14beta,16.), DSSTox_GSID_40134, Cerebroxine, Vincaminum, Vincamina, methyl 14beta-hydroxy-14,15-dihydro-3alpha,16alpha-eburnamenine-14alpha-carboxylate, Teprosilic Acid, (3?,14?,16?)-14,15-Dihydro-14-hydroxyeburnamenine-14-carboxylic acid methyl ester, Vincamine (FP), NCGC00094824-01, Vincamine (INN), Prestwick_495, CAS-1617-90-9, Cetal retard (TN), Vincamine, 98%, Prestwick0_000271, Prestwick1_000271, Prestwick2_000271, Prestwick3_000271, Vincamine, 98% 1g, D08UGJ, AC1L25RL, BSPBio_000142, GTPL349, MLS002154249, SCHEMBL147179, SPBio_002361, BPBio1_000158, CHEMBL1165342, DTXSID9040134, BCBcMAP01_000080, MolPort-002-510-941, HMS1568H04, HMS2095H04, HMS2268C20, HMS3712H04, BCP05837, HY-B1021, ZINC1069082, Tox21_111342, Tox21_301968, MFCD00078054, AKOS015896471, Tox21_111342_1, API0004593, CCG-208544, CS-4536, DB13374, EBD2197880, KS-5179, SMP1_000314, Vincamine, analytical reference material, NCGC00184983-01, NCGC00184983-03, NCGC00255542-01, AC-22625, AK163212, AN-49543, BC681377, SC-19228, SMR000112509, AX8156430, LS-162175, ST24050348, C09251, D08677, J10447, 617V909, I06-1879, Q-100193, BRD-K40902647-001-03-7, methyl (3alpha,14beta,16alpha)-14-hydroxy-14,15-dihydroeburnamenine-14-carboxylate, Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-,methyl ester, (3alpha,14beta,16alpha)-, methyl (15S,17S,19S)-15-ethyl-17-hydroxy-1,11-diazapentacyclo[9.6.2.0?,?.0?,??.0??,??]nonadeca-2,4,6,8(18)-tetraene-17-carboxylate, methyl (15S,17S,19S)-15-ethyl-17-hydroxy-1,11-diazapentacyclo[9.6.2.0^{2,7}.0^{8,18}.0^{15,19}]nonadeca-2,4,6,8(18)-tetraene-17-carboxylate


ID: 2036

chemical graph of compound 2036



InChIKey: RXPRRQLKFXBCSJ-HLAWJBBLSA-N
SMILES: CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4[C@@](C2)(C(=O)OC)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 637570
synonyms found at PubChem are:
Epivincamine, CHEBI:70504, 6835-99-0, Prestwick_873, (+)-Vincamin, AC1LCUI5, Prestwick0_000636, Prestwick1_000636, Prestwick2_000636, Prestwick3_000636, Spectrum2_001338, Spectrum3_001381, Spectrum4_000996, Spectrum5_000664, BSPBio_000632, BSPBio_002962, KBioGR_001431, MLS002153925, DivK1c_000167, SPECTRUM1500647, SPBio_001495, SPBio_002851, BPBio1_000696, CHEMBL1728279, SCHEMBL14095103, HMS500I09, KBio1_000167, KBio3_002182, NINDS_000167, HMS1569P14, HMS1921O09, HMS2096P14, HMS2234I20, Pharmakon1600-01500647, ZINC3875273, CCG-38834, NSC757405, NSC-757405, SDCCGMLS-0066588.P001, IDI1_000167, SMR001233269, SBI-0051576.P002, AB00052139_02, BRD-K89704198-001-05-7, BRD-K89704198-001-08-1


ID: 2037

chemical graph of compound 2037



InChIKey: RYAMDQKWNKKFHD-JXMROGBWSA-N
SMILES: COC1=CC=CC(=C1)NC(=O)/C=C/C2=CC=C(C=C2)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 667594
synonyms found at PubChem are:
SB-366791, 472981-92-3, SB 366791, SB366791, (2E)-3-(4-chlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide, N-(3-Methoxyphenyl)-4-chlorocinnamide, N-(3-methoxyphenyl)-4-chlorocinnamanilide, 1649486-65-6, SB-366,791, AC1LDIF9, 3-(4-chlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide, 2-Propenamide, 3-(4-chlorophenyl)-N-(3-methoxyphenyl)-, CHEMBL122413, GTPL4309, ZINC9321, BDBM20488, CHEBI:93038, MolPort-001-491-057, BCP17766, EX-A1109, GL6242, MFCD01033818, s8238, STK202522, AKOS002529706, CS-5658, ES-0017, NCGC00025231-02, HY-12245, ZB000678, B6804, ST50688751, SB-366791, >=98% (HPLC), powder, SB366791 (SB-366791), SR-01000597592, SR-01000597592-1, (e)-3-(4-chlorophenyl)-n-(3-methoxyphenyl)acrylamide, BRD-K59331372-001-01-2, (E)-3-(4-chlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide


ID: 2038

chemical graph of compound 2038



InChIKey: RYAXABNGWYEGTO-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C2=CN=C(N2)SCC(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Br

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"N Pedemonte" "K Du" "GL Lukacs" "E Caci" "LJ Galietta" "AS Verkman" "O Zegarra-Moran"


CID is 1008236
synonyms found at PubChem are:
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide, AC1LJXGB, Oprea1_477754, Oprea1_602653, SCHEMBL837694, MolPort-002-704-370, MolPort-003-819-155, ZINC1062392, STK793160, AKOS001014760, AKOS001741629, MCULE-8210024769, EU-0052043, A1954/0082128, N~1~-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-[(4-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide


ID: 2039

chemical graph of compound 2039



InChIKey: RYEFFICCPKWYML-QCGISDTRSA-N
SMILES: C[C@@]12[C@H]3[C@H]4[C@H]([C@@H]([C@@]1(C[C@@H]5[C@]2(O5)C(=O)O3)O)C(=O)O4)C(C)(C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 442291
synonyms found at PubChem are:
picrotin, 21416-53-5, DSSTox_CID_25605, DSSTox_RID_80998, UNII-U06Z6QD7N2, DSSTox_GSID_45605, CHEBI:8205, CHEMBL478523, U06Z6QD7N2, CAS-124-87-8, ST057242, (5S,8S,12S,14S,1R,3R,9R,13R)-1-hydroxy-14-(1-hydroxy-isopropyl)-13-methyl-4,7, 10-trioxapentacyclo[6.4.1.1<9,12>.0<3,5>.0<5,13>]tetradecane-6,11-dione, Pikrotin, NSC 129536, Picrotin (from Anamirta cocculus seed), BRN 5302552, NCGC00017246-02, 3,6-Methano-8H-1,5,7-trioxacyclopenta(ij)cycloprop(a)azulene-4,8(3H)-dione, hexahydro-2a-hydroxy-9-(1-hydroxy-1-methylethyl)-8b-methyl-, (1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-, AI3-41570, Spectrum_000413, AC1L9CJW, Spectrum2_000279, Spectrum3_000073, Spectrum4_001781, Spectrum5_000421, D0V9XF, Picrotin (VAN) (8CI), BSPBio_001885, KBioGR_002323, KBioSS_000893, SPECTRUM100346, DivK1c_000756, SPBio_000158, GTPL4286, SCHEMBL1688919, HMS502F18, KBio1_000756, KBio2_000893, KBio2_003461, KBio2_006029, KBio3_001105, DTXSID80274161, NINDS_000756, HMS1922N10, 3,6-Methano-8H-1,5,7-trioxacyclopenta(ij)cycloprop(a)azulene-4,8(3H)-dione, hexahydro-2a-hydroxy-9-(1-hydroxy-1-methylethyl)-8b-methyl-, (1aR-(1a alpha,2a beta,3beta,6beta,6a beta,8aS*,8b beta,9S*))-, ZINC3995861, Tox21_110806, Tox21_111261, BDBM50269961, CCG-39837, AKOS024282616, SDCCGMLS-0066351.P001, IDI1_000756, SMP1_000239, NCGC00142523-02, CC-33785, FT-0630472, C09528, C-19226, Q-100267, UNII-ZLT174DL7U component RYEFFICCPKWYML-QCGISDTRSA-N, (1R,3R,5S,8S,9R,12S,13R,14S)-1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione


ID: 2040

chemical graph of compound 2040



InChIKey: RYFKTZXULZNOCC-UHFFFAOYSA-N
SMILES: CNNC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 134414
synonyms found at PubChem are:
1,2-dimethylhydrazine hydrochloride, 1,2-dimethylhydrazine hydrochloride(1:1), sym-Dimethylhydrazine hydrochloride, Hydrazine, 1,2-dimethyl-, hydrochloride, Dimethylhydrazine dihydrochloride, AC1Q3CHZ, AC1L34JU, EBD750, CHEMBL3039322, CTK8D7681, RYFKTZXULZNOCC-UHFFFAOYSA-N, WLN: 1MM1 & GH 2, NSC60518, 1,2-Dimethyl-hydrazine Hydrochloride, CCG-39892, NSC-60518, AKOS004907805, Hydrazine,2-dimethyl-, dihydrochloride, LS-76760, N,N'-dimethylhydrazine hydrochloride salt, SC-92981


ID: 2041

chemical graph of compound 2041



InChIKey: RYHCACJBKCOBTJ-UHFFFAOYSA-N
SMILES: CCN(CCCC1=CC=CC=C1)CCCC2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 21718
synonyms found at PubChem are:
ALVERINE CITRATE, 5560-59-8, Alverine (citrate), ALVERINE CITRATE SALT, NCI 85x, UNII-9JFB58YK1E, NSC 35459, 9JFB58YK1E, MLS000069524, CHEBI:53785, N-Ethyl-3,3'-diphenyldipropylamine citrate (1:1), NCGC00017047-01, SMR000058631, CAS-5560-59-8, DSSTox_CID_25562, DSSTox_RID_80959, DSSTox_GSID_45562, N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine 2-hydroxypropane-1,2,3-tricarboxylate, SR-01000003029, Alverine dihydrogen citrate, Alverine citrate [USAN:NF], alverine; citro, Alverrine citrate, Alverine(citrate), Prestwick_912, EINECS 226-929-3, AC1L2IXM, Opera_ID_1477, Alverine citrate (USAN), PHENPROPAMINE CITRATE, Dipropylamine, N-ethyl-3,3'-diphenyl-, citrate, N-Ethyl-bis(3-phenylpropyl)amin-dihydrogencitrat, MLS001148462, MLS002207301, MLS002222279, MLS004712036, SCHEMBL352008, SPECTRUM1500109, REGID_for_CID_21718, CHEMBL1408594, DTXSID3045562, MolPort-003-666-118, HMS1568D09, HMS1920A17, HMS2091G17, HMS2095D09, HMS2232D03, HMS3371I14, HMS3651F18, HMS3712D09, Pharmakon1600-01500109, HY-B0500, KS-00001F7G, Tox21_110757, CA0130, Dipropylamine,3'-diphenyl-, citrate, N-Ethyl-3,3 -diphenlyldipropylamine, N-Ethyl-3,3'-diphenlyldipropylamine, NSC-35459, NSC755859, s3054, AKOS015895657, Tox21_110757_1, API0001434, CCG-212472, CS-2694, MCULE-5221384643, NSC-755859, VA10244, NCGC00017047-02, NCGC00017047-03, NCGC00021122-08, NCGC00094581-01, NCGC00094581-02, AK110378, AX8009252, N-Ethyl-3,3'-diphenyldipropylamine citrate, Dipropylamine,3'-diphenyl-, citrate (1:1), FT-0622247, V0594, D02877, A830720, SR-01000003029-2, SR-01000003029-4, bis-gamma-PHENYLPROPYLETHYLAMINE DIHYDROGEN CITRATE, Dipropylamine, N-ethyl-3,3'-diphenyl-, citrate (1:1) (8CI), Benzenepropanamine, 2-hydroxy-1,2,3-propanetricarboxylate (1:1), Alverine citrate salt, European Pharmacopoeia (EP) Reference Standard, Alverine for peak identification, European Pharmacopoeia (EP) Reference Standard, Benzenepropanamine, N-ethyl-N-(3-phenylpropyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1) (9CI), N-ethyl-3-phenyl-N-(3-phenylpropyl)-1-propanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid, N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid, N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid, N-OO>>u-3,3 inverted exclamation marka- paragraph signthorn+/-(1/2) paragraph signthorn+/-u degrees .


ID: 2042

chemical graph of compound 2042



InChIKey: RYMZZMVNJRMUDD-HGQWONQESA-N
SMILES: CCC(C)(C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 54454
synonyms found at PubChem are:
simvastatin, 79902-63-9, Zocor, Synvinolin, Sinvacor, Denan, Lipex, MK-733, Simvastatine, Sivastin, Lodales, Simvastatina, Simvastatinum, Cholestat, Colemin, Simovil, Medipo, Pantok, Simvastatin lactone, Labistatin, Nivelipol, Rendapid, Vasotenal, Velostatin, Coledis, Corolin, Zocord, Simvastatin (Zocor), Lipovas, Rechol, Zorced, Simvastatine [French], Simvastatinum [Latin], Simvastatina [Spanish], Simcard, Simvacor, Simvoget, Simlup, UNII-AGG2FN16EV, Simvast CR, DRG-0320, (1S,3R,7S,8S,8aR)-8-(2-((2R,4R)-4-Hydroxy-6-oxotetrahydro-2H-pyran-2-yl)ethyl)-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate, MK 0733, MK-0733, Simvastatin [USAN:INN:BAN], CCRIS 7558, Zocor (TN), Simvastatin, Compactin, HSDB 7208, Simvastatin & Primycin, AGG2FN16EV, 2,2-Dimethylbutyric acid, 8-ester with (4R,6R)-6-(2-((1S,2S,6R,8S,8aR)-1,2,6,7,8,8a-hexahydro-8-hydroxy-2,6-dimethyl-1-naphthyl)ethyl)tetrahydro-4-hydroxy-2H-pyran-2-one, L 644128-000U, BRN 4768037, Statin, CHEBI:9150, (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate, RYMZZMVNJRMUDD-HGQWONQESA-N, C25H38O5, TNP00259, [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate, Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester, KS-1113, DSSTox_CID_3581, DSSTox_RID_77090, DSSTox_GSID_23581, (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate, Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-(2-((2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl)-1-naphthalenyl ester, Zosta, [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxo-tetrahydropyran-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate, 2,2-Dimethylbutanoic acid (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester, Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,*aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-(2-((2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl)-1-naphthalenyl ester, Butanoic acid, 2,2-dimethyl-, 1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-(2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl)-1-naphthalenyl ester, (1S-(1alpha,3alpha,7beta,8beta(2S*,4S*),8abeta))-, butanoic acid, 2,2-dimethyl-,1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)-ethyl]-1-naphthalenyl ester, [1S-[1 alpha,3 alpha,7 beta,8 beta(2S*,4S*),-8a beta, SMR000718785, SR-05000001894, simvastol, Kolestevan, Lipinorm, Modutrol, Simvotin, Sinvascor, Valemia, Eucor, Nor-Vastina, Simvastatin,(S), simvastatin predrug, (+)-Simvastatin, MK733, NCGC00016940-01, inactive simvastatin, Simvacor (TN), 8-[2-((2R,4R)-4-hydroxy-6-oxo(2H-3,4,5-trihydropyran-2-yl))ethyl](1S,7S,8S,3R, 8aR)-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthyl 2,2-dimethylbutanoate, Simvastatin [USAN:USP:INN:BAN], Prestwick_171, Simcard (TN), CAS-79902-63-9, MK 733, Simlup (TN), Spectrum_001717, SpecPlus_000895, Prestwick0_000865, Prestwick1_000865, Prestwick2_000865, Prestwick3_000865, Spectrum2_001671, Spectrum3_000669, Spectrum4_000632, Spectrum5_001428, D0H0ND, AC1L1H1F, SCHEMBL2471, CHEMBL1064, BSPBio_000909, BSPBio_002337, KBioGR_001244, KBioSS_002197, MLS001304029, MLS001333077, MLS001333078, MLS002154038, MLS006011866, ARONIS24119, BIDD:GT0769, DivK1c_006991, Simvastatin (JAN/USP/INN), SPECTRUM1504236, SPBio_001881, SPBio_002830, BPBio1_001001, GTPL2955, Simvastatin (JP17/USP/INN), Simvastatin, analytical standard, DTXSID0023581, BCBcMAP01_000007, KBio1_001935, KBio2_002197, KBio2_004765, KBio2_007333, KBio3_001557, RYMZZMVNJRMUDD-HGQWONQESA-, MolPort-002-507-345, HMS1570N11, HMS1922H13, HMS2089D12, HMS2093E06, HMS2097N11, HMS2231N22, HMS3259B12, HMS3714N11, Pharmakon1600-01504236, ZINC3780893, Tox21_110696, Tox21_300400, BBL024390, BDBM50139181, CCG-39069, MFCD00072007, NSC633782, NSC758706, s1792, SBB080618, STK801938, AKOS005111006, AKOS015842733, Simvastatin, >=97% (HPLC), solid, Tox21_110696_1, AC-1530, AN-7250, AT-7048, CS-2269, DB00641, MCULE-8390617062, NC00719, NSC-633782, NSC-758706, MRF-0000729, NCGC00017324-01, NCGC00017324-02, NCGC00017324-03, NCGC00017324-04, NCGC00017324-05, NCGC00017324-07, NCGC00017324-08, NCGC00254418-01, AJ-45588, BC203244, CPD000718785, HY-17502, LS-46264, SAM002589969, SC-12666, ST057168, SBI-0206773.P001, AB0069097, ST2407853, D00434, J10128, W-3044, 28049-EP2269989A1, 28049-EP2269990A1, 28049-EP2270011A1, 28049-EP2270505A1, 28049-EP2272825A2, 28049-EP2272841A1, 28049-EP2277865A1, 28049-EP2280001A1, 28049-EP2280006A1, 28049-EP2281813A1, 28049-EP2284158A1, 28049-EP2287165A2, 28049-EP2287166A2, 28049-EP2292620A2, 28049-EP2295406A1, 28049-EP2295409A1, 28049-EP2295417A1, 28049-EP2295422A2, 28049-EP2298731A1, 28049-EP2298742A1, 28049-EP2298745A1, 28049-EP2298769A1, 28049-EP2298772A1, 28049-EP2298776A1, 28049-EP2298779A1, 28049-EP2301923A1, 28049-EP2301931A1, 28049-EP2301936A1, 28049-EP2305219A1, 28049-EP2305648A1, 28049-EP2308839A1, 28049-EP2308878A2, 28049-EP2314588A1, 96639-EP2287163A1, 96639-EP2305678A1, 99548-EP2270011A1, 99548-EP2298779A1, 99548-EP2301923A1, 99548-EP2301931A1, AB00053395-07, AB00053395-08, AB00053395-10, AB00053395_11, AB00053395_13, 902S639, SR-05000001894-1, SR-05000001894-2, BRD-K22134346-001-05-8, BRD-K22134346-001-11-6, BRD-K22134346-001-15-7, Z1741982918, Simvastatin, British Pharmacopoeia (BP) Reference Standard, Simvastatin, European Pharmacopoeia (EP) Reference Standard, Simvastatin, United States Pharmacopeia (USP) Reference Standard, Zocor, Simlup, Simcard, Simvacor, Simvoget, Zorced, Simvastatin, Simvastatin, Pharmaceutical Secondary Standard; Certified Reference Material, Simvastatin for peak identification, European Pharmacopoeia (EP) Reference Standard, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-Hexahydro-3,7-dimethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyly-2,2-dimethyl butanoate, (1S,3R,7S,8S,8aR)-8-(2-((2R,4R)-4-Hydroxy-6-oxotetrahydro-2H-pyran-2-yl)ethyl)-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbu, (1S,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate, InChI=1/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1


ID: 2043

chemical graph of compound 2043



InChIKey: RZAMWZFIYNLWRM-UHFFFAOYSA-N
SMILES: C(C1=C(C)C=CS1)1C(C(=O)OCC)=C(C)NC(C)=C1C(=O)OCC

biological descriptors:

CFTR relevance: CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"N Pedemonte" "MT Mazzei" "M Zacchigna" "M Giampieri" "LJ Galietta" "P Fossa" "M Mazzei" "F Cateni"


CID is 741915
synonyms found at PubChem are:
SMR000176561, AC1LEU12, Oprea1_492418, Oprea1_623849, MLS000551988, CHEMBL594099, CHEMBL1506056, MolPort-001-956-785, HMS2366P22, AKOS000531381, ZINC100098559, MCULE-7304301475, BAS 01152205, ST50562895, SR-01000425624, SR-01000425624-1, diethyl 2,6-dimethyl-4-(3-methyl-2-thienyl)-1,4-dihydro-3,5-pyridinedicarboxylate, diethyl 2,6-dimethyl-4-(3-methylthiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate, 2,6-Dimethyl-4-(3-methyl-2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester, 2,6-Dimethyl-4-(3-methyl-thiophen-2-yl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid diethyl ester, ethyl 5-(ethoxycarbonyl)-2,6-dimethyl-4-(3-methyl(2-thienyl))-1,4-dihydropyrid ine-3-carboxylate


ID: 2044

chemical graph of compound 2044



InChIKey: RZCJLMTXBMNRAD-UHFFFAOYSA-N
SMILES: CC(CC1=CC=C(C=C1)O)N.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 9377
synonyms found at PubChem are:
HYDROXYAMPHETAMINE HYDROBROMIDE, Predrolon, Mycadrine, Paredrine hydrobromide, p-Hydroxyamphetamine hydrobromide, 4-(2-Aminopropyl)phenol hydrobromide, 306-21-8, Hydroxyamfetamin hydrobromid, (+-)-Paredrine hydrobromide, EINECS 206-181-4, NSC 61065, 2-Amino-1-(4-hydroxyphenyl)propane hydrobromide, 3-(p-Hydroxyphenyl)-2-aminopropane hydrobromide, dl-p-(2-Aminopropyl)phenol hydrobromide, Phenol, 4-(2-aminopropyl)-, hydrobromide, (+-)-p-(2-Aminopropyl)phenol hydrobromide, 1-p-Hydroxyphenyl-2-aminopropane hydrobromide, beta-(p-Hydroxyphenyl)isopropylamine hydrobromide, Phenol, p-(2-aminopropyl)-, hydrobromide, (+-)-, Hydroxyamphetamine hydrobromide [USP], NCGC00095233-01, Phenol, p-(2-aminopropyl)-, hydrobromide, hydroxyamfetamine hydrobromide, Hydroxyamphetamine hydrobromide (USP), Paredrine (TN), Phenol, hydrobromide, 4-(2-aminopropyl)ph |nol bromhydrate, component of Paredrine, AC1L1SWY, C9H13NO.HBr, D0W1RY, AC1Q23OC, cid_9377, Hyroxyamfetamine hydrobromide, DSSTox_CID_25961, DSSTox_RID_81257, DSSTox_GSID_45961, SPECTRUM211425, MLS002320672, MLS002320674, SCHEMBL221647, 103-86-6 (Parent), CHEMBL1200705, DTXSID0045961, OXAMPHETAMINE HYDROBROMIDE, CTK4G5491, WLN: ZY1&1R DQ &EH, RZCJLMTXBMNRAD-UHFFFAOYSA-N, HMS1923C15, Pharmakon1600-00211425, NSC61065, Tox21_111487, NSC-61065, NSC760066, p-(2-Aminopropyl)phenol hydrobromide, p-(2-Aminopropyl)phenyl hydrobromide, (+)-4-Hydroxyamphetamine hydrobromide, CCG-213716, NSC-760066, (+/-)-4-Hydroxyamphetamine hydrobromide, NCGC00095233-02, 140-36-3, CAS-306-21-8, SMR001338818, SMR001338820, LS-103951, LS-103952, D04473, Phenol,4-(2-aminopropyl)-, hydrobromide (1:1), .beta.-(p-Hydroxyphenyl)isopropylamine hydrobromide, rac. 4-hydroxy-alpha-methylphenethylamine hydrobromide, AC1LAP2W, 2-Propanamine, 1-(4-hydroxyphenyl)-, hydrobromide, 1-(4-hydroxyphenyl)propan-2-ylazanium bromide


ID: 2045

chemical graph of compound 2045



InChIKey: RZEKVGVHFLEQIL-UHFFFAOYSA-N
SMILES: CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2662
synonyms found at PubChem are:
celecoxib, Celebrex, 169590-42-5, Celebra, Onsenal, Celocoxib, Celecox, SC 58635, Xilebao, YM177, SC-58635, 4-[5-(4-METHYLPHENYL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-1-YL]BENZENESULFONAMIDE, Celecoxib [USAN], Celecoxib [Old RN], YM 177, Celecoxibum, Celecoxi, Solexa, 184007-95-2, HSDB 7038, UNII-JCX84Q7J1L, Celebrex (TN), C17H14F3N3O2S, p-(5-p-Tolyl-3-(trifluoromethyl)pyrazol-1-yl)benzenesulfonamide, 4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide, 4-(5-(4-Methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonamide, YM-177, CHEMBL118, SC58635, JCX84Q7J1L, Celecoxib (SC-58635), Celecoxib (JAN/USAN/INN), 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]benzene-1-sulfonamide, CHEBI:41423, TPI-336, RZEKVGVHFLEQIL-UHFFFAOYSA-N, AI-525, CEP-33222, NCGC00091455-01, DSSTox_CID_2777, SC-58553, SC-58635, 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]-benzenesulfonamide, benzenesulfonamide, 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]-, DSSTox_RID_76725, DSSTox_GSID_22777, 194044-54-7, 4-[5-(p-tolyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide, 4-(5-(p-tolyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonamide, 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1Hpyrazol-1-yl] benzenesulfonamide, Benzenesulfonamide, 4-(5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)-, Benzenesulfonamide,4-(5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl), SMR000550473, CAS-169590-42-5, SR-01000837528, Eurocox, Medicoxib, Celecoxib [USAN:INN:BAN], CCRIS 8679, CCRIS 9330, Celebra (TN), Onsenal (TN), CELEBCOXIB, Spectrum_000432, 1oq5, Pfizer brand of celecoxib, Spectrum2_001576, Spectrum3_001996, Spectrum4_000182, Spectrum5_001324, D03RTS, AC1L1E6K, Celecoxib/Celebrex, Celebra, cid_2662, SCHEMBL3708, BSPBio_003596, Celebrex, Celebra, Celecoxib, KBioGR_000723, KBioGR_002351, KBioSS_000912, KBioSS_002354, MLS001165684, MLS001195656, MLS001304708, MLS006011862, BIDD:GT0408, DivK1c_000893, SPECTRUM1503678, SPBio_001512, GTPL2892, Celecoxib, >=98% (HPLC), DTXSID0022777, BDBM11639, CTK8H4475, HMS502M15, KBio1_000893, KBio2_000912, KBio2_002351, KBio2_003480, KBio2_004919, KBio2_006048, KBio2_007487, KBio3_002830, KBio3_003037, EX-A175, SYN3015, cMAP_000027, MolPort-002-885-815, NINDS_000893, BCPP000290, HMS1922G14, HMS2089L18, HMS2093I07, HMS2234N18, HMS3259L08, HMS3261A14, HMS3373A09, HMS3654H09, HMS3715F11, Pharmakon1600-01503678, ACT02648, BCP02156, EBD24636, KS-00000FW2, ZINC2570895, Tox21_111135, Tox21_201964, Tox21_300599, Tox21_500406, US8741944, Comparative Compound, ABP000291, BBL029086, CCG-39354, MFCD00941298, NSC719627, NSC758624, s1261, STL373576, Celecoxib 1.0 mg/ml in Acetonitrile, AKOS015842517, Tox21_111135_1, AC-4228, AM84588, AT-3762, BCP9000507, Celebrex, Celebra, 169590-42-5, CS-0570, DB00482, KS-1041, MCULE-4750749400, NC00708, NSC-719627, NSC-758624, RL02184, IDI1_000893, NCGC00091455-02, NCGC00091455-03, NCGC00091455-04, NCGC00091455-05, NCGC00091455-06, NCGC00091455-07, NCGC00091455-08, NCGC00091455-09, NCGC00091455-13, NCGC00254540-01, NCGC00259513-01, NCGC00261091-01, AN-12211, BC209720, BP-30217, CPD000550473, HY-14398, KB-76000, LS-31667, NCI60_041049, PHA-00846533, SAM002589995, SC-50829, SBI-0051875.P002, AB0012055, CJ-016377, CP-598107, TL8001323, UNM-0000305813, FT-0080064, FT-0601628, FT-0623536, FT-0700357, PF-00345549, A25046, C-6317, C07589, D00567, J10035, AB00052396-07, AB00052396-08, AB00052396-09, AB00052396_10, AB00052396_11, Celecoxib|169590-42-5|Celebrex|SC 58635, 590C425, I01-1033, J-010566, J-520011, Q-200816, SR-01000837528-2, SR-01000837528-3, BRD-K02637541-001-02-4, BRD-K02637541-001-06-5, Z2210694606, Celecoxib, European Pharmacopoeia (EP) Reference Standard, Celecoxib, United States Pharmacopeia (USP) Reference Standard, 4-[5-(4-Methylphenyl)-3-(trifluoromethyl)-pyrazol-1-yl]benzenesulfonamide, 5-(4-Methylphenyl)-1-(4-sulfamoylphenyl)-3-(trifluoromethyl)pyrazole, Celecoxib, Pharmaceutical Secondary Standard; Certified Reference Material, Benzenesulfonamide,4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]-


ID: 2046

chemical graph of compound 2046



InChIKey: RZFNKJVCPDLQQA-UHFFFAOYSA-N
SMILES: CCN(CC)CCCC(C)NC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC.O.O.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2725002
synonyms found at PubChem are:
Quinacrine dihydrochloride dihydrate, 6151-30-0, Chemiochin, Malaricida, Methoquine, Mecryl, Erion, Quinacrine HCl, Quinacrine hydrochloride, Mepacrine hydrochloride, acrichine, Atabrine dihydrochloride, Atabrine hydrochloride dihydrate, Mepacrine hydrochloride dihydrate, Quinacrine hydrochloride dihydrate, Mepacrine HCl, 6-Chloro-9-((4-(diethylamino)-1-methylbutyl)amino)-2-methoxyacridine dihydrochloride dihydrate, DSSTox_CID_25565, DSSTox_RID_80962, DSSTox_GSID_45565, 83-89-6 (Parent), 6-Chloro-9-((4-(diethylamino)-1-methylbutyl) amino)-2-methoxyacridine dihydrochloride, 1,4-Pentanediamine, N(sup 4)-(6-chloro-2-methoxy-9-acridinyl)-N(sup 1),N(sup 1)-diethyl-, dihydrochloride, dihydrate, Acridine, 6-chloro-9-((4-(diethylamino)-1-methylbutyl)amino)-2-methoxy-, dihydrochloride, dihydrate, CCRIS 8684, Quinacrine hydrochloride [USP], NCGC00017057-01, Prestwick_650, CAS-6151-30-0, AC1MBFYF, C23H36Cl3N3O3, CHEMBL2105615, DTXSID8045565, MolPort-018-655-037, C23H30ClN3O.2HCl.2H2O, HMS1568P18, quinacrine dihydrate dihydrochloride, Tox21_110762, Quinacrine Dihydrochloride, Dihydrate, AKOS004910405, Tox21_110762_1, API0004011, CCG-220318, NCGC00015874-05, AC-22752, LS-14294, FT-0698684, 4-N-(6-chloro-2-methoxyacridin-9-yl)-1-N,1-N-diethylpentane-1,4-diamine dihydrate dihydrochloride, Acridine, 6-chloro-9-((4-(diethylamino)-1-methylbutyl)amino)-2-methoxy-, dihydrochloride,dihydrate, AKOS015901751, I14-14286


ID: 2047

chemical graph of compound 2047



InChIKey: RZFVLEJOHSLEFR-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3NC2=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 1853
synonyms found at PubChem are:
6(5H)-Phenanthridinone, 1015-89-0, Phenanthridin-6(5H)-one, Phenanthridone, 6-Phenanthridinol, 6-(5H)-phenanthridinone, 6-Phenanthridinone, 6-Phenanthridone, 5H-phenanthridin-6-one, 6(5H)-Phenanthridone, Phenantridone, phenanthridin-6-ol, Phenanthridone (misnomer), 5,6-dihydrophenanthridin-6-one, 6(5H)-Phenantridinone, UNII-AVQ13AUB5J, NSC 11021, NSC 40943, NSC 61083, CCRIS 2978, EINECS 213-804-3, AVQ13AUB5J, CHEMBL45245, AI3-16988, CHEBI:75292, RZFVLEJOHSLEFR-UHFFFAOYSA-N, F3193-0003, SR-01000076089, 4avu, 6-hydroxyphenanthridine, ACMC-1BQKN, AC1L1CDU, AC1Q1HKG, AC1Q6GQP, Maybridge1_005473, Lopac-P-8852, 6 (5H)-Phenanthridinone, 5-hydrophenanthridin-6-one, Lopac0_000994, Oprea1_280753, Oprea1_801444, SCHEMBL17293, BSPBio_001022, KBioGR_000362, KBioSS_000362, KSC153O0N, MLS000681669, DivK1c_001761, DTXSID0074423, 5H-Phenanthridin-6-one (PTD), BCBcMAP01_000038, BDBM27500, HMS557A17, KBio2_000362, KBio2_002930, KBio2_005498, KBio3_000703, KBio3_000704, MolPort-000-876-028, MolPort-001-016-024, Bio1_000401, Bio1_000890, Bio1_001379, Bio2_000351, Bio2_000831, HMS1362D03, HMS1792D03, HMS1990D03, HMS2588H14, HMS3263G09, HMS3403D03, ACT09372, ALBB-023266, EBD51560, KS-00000FC5, NSC11021, NSC40943, NSC61083, ZINC8580818, Tox21_500994, ANW-14492, BBL034640, CCG-15140, MFCD00004988, NSC-11021, NSC-40943, NSC-61083, SBB076279, STL426846, STL426852, 6(5H)-Phenanthridinone, 96% 1g, AKOS002287896, AKOS003245230, DS-0778, LP00994, MCULE-7620392745, RP25373, CDS1_000721, IDI1_002106, NCGC00015852-01, NCGC00015852-02, NCGC00015852-03, NCGC00015852-04, NCGC00015852-05, NCGC00015852-06, NCGC00094290-01, NCGC00094290-02, NCGC00094290-03, NCGC00261679-01, AJ-57665, AN-48322, BR-32173, CJ-13252, EN002717, SC-29255, SMR000312353, 6-(5H)-Phenanthridinone, technical grade, AB0034412, DB-007109, LS-102982, 4CH-006771, AM20070167, CS-0019648, EU-0100994, FT-0081345, FT-0620806, P1998, ST45024582, X8565, EN300-36056, P 8852, S-1687, 015P890, CU-00000000136-1, J-518037, SR-01000076089-1, SR-01000076089-2, BRD-K11163873-001-02-8, I14-51197, Z275368072


ID: 2048

chemical graph of compound 2048



InChIKey: RZJQGNCSTQAWON-UHFFFAOYSA-N
SMILES: CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)OC2)C3=CC=CC=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5090
synonyms found at PubChem are:
rofecoxib, 162011-90-7, Vioxx, Ceoxx, MK 966, 4-[4-(methylsulfonyl)phenyl]-3-phenylfuran-2(5H)-one, 4-(4-(Methylsulfonyl)phenyl)-3-phenylfuran-2(5H)-one, MK 0966, 4-[4-(methylsulfonyl)phenyl]-3-phenyl-2(5H)-furanone, MK-966, MK-0966, UNII-0QTW8Z7MCR, 3-(4-methylsulfonylphenyl)-4-phenyl-2H-furan-5-one, Vioxx (trademark), MK0966, Rofecoxib (Vioxx), CCRIS 8967, Vioxx (TN), HSDB 7262, MK 996, 0QTW8Z7MCR, CHEMBL122, 4-(4-methylsulfonylphenyl)-3-phenyl-5H-furan-2-one, Rofecoxib (JAN/USAN/INN), 3-phenyl-4-[4-(methylsulfonyl)phenyl]-2(5H)-furanone, 4-(4-(Methylsulfonyl)phenyl)-3-phenyl-2(5H)-furanone, 3-Phenyl-4-(4-(methylsulfonyl)phenyl))-2(5H)-furanone, CHEBI:8887, C17H14O4S, RZJQGNCSTQAWON-UHFFFAOYSA-N, 4-(p-(Methylsulfonyl)phenyl)-3-phenyl-2(5H)-furanone, KS-1107, MK 0996, NCGC00095118-01, 2(5H)-Furanone, 4-(4-(methylsulfonyl)phenyl)-3-phenyl-, 2(5H)-Furanone, 4-[4-(methylsulfonyl)phenyl]-3-phenyl-, refecoxib, 4-(4-METHANESULFONYL-PHENYL)-3-PHENYL-5H-FURAN-2-ONE, Vioxx Dolor, 186912-82-3, SMR000466331, SR-01000762904, ceeoxx, rofecoxibum, Rofecoxib [USAN:INN:BAN], Ceeoxx (TN), Ceoxx (TN), 544684-93-7, MSD brand of rofecoxib, PubChem15028, Spectrum_000119, SpecPlus_000669, Merck brand of rofecoxib, Spectrum2_000446, Spectrum3_001153, Spectrum4_000631, Spectrum5_001598, DSSTox_CID_3567, D05VLS, AC1L1JL6, SCHEMBL3050, DSSTox_RID_77084, DSSTox_GSID_23567, BSPBio_002705, KBioGR_001242, KBioGR_002345, KBioSS_000559, KBioSS_002348, MLS000759440, MLS001165770, MLS001195623, MLS001424113, MLS006010091, BIDD:GT0399, DivK1c_006765, Merck Frosst brandof rofecoxib, SPECTRUM1504235, SPBio_000492, 3-(4-methanesulfonylphenyl)-2-phenyl-2-buten-4-olide, GTPL2893, ZINC7455, Jsp003237, DTXSID2023567, BDBM22369, KBio1_001709, KBio2_000559, KBio2_002345, KBio2_003127, KBio2_004913, KBio2_005695, KBio2_007481, KBio3_002205, KBio3_002825, KS-00000XKS, AOB6956, EX-A708, TRM-201, cMAP_000024, MolPort-000-883-878, MolPort-006-817-786, HMS1922H11, HMS2051G16, HMS2089H20, HMS2093E04, HMS2232G21, HMS3371P11, HMS3393G16, HMS3651F16, HMS3713B07, MK966, Pharmakon1600-01504235, BCP03619, EBD34785, Tox21_111430, ANW-71936, CCG-40253, NSC720256, NSC758705, s3043, STK635144, Cahill May Roberts brand of rofecoxib, AKOS000280931, AB07701, CS-0997, DB00533, MCULE-4806636118, NC00132, NSC-720256, NSC-758705, VA11689, Merck Sharp & Dhome brand of rofecoxib, NCGC00095118-02, NCGC00095118-03, NCGC00095118-04, NCGC00095118-05, NCGC00095118-08, AC-28318, AJ-08299, AN-25306, CPD000466331, HY-17372, LS-70511, NCI60_041175, SAM001246617, SC-17320, ZB000656, SBI-0206774.P001, AB0012045, RT-016235, ST2410970, CAS-162011-90-7, FT-0081390, FT-0631192, R0206, C07590, D00568, J10420, K-5064, AB00052090-06, AB00052090-08, AB00052090_09, AB00052090_10, 011R907, A810324, L000912, I01-1042, Q-201676, SR-01000762904-3, SR-01000762904-5, BRD-K21733600-001-02-6, BRD-K21733600-001-06-7, 3-(4-methanesulfonyl-phenyl)-2-phenyl-2-buten-4-olide, 2(5H)-Furanone, 4-[4-(methyl-sulfonyl)phenyl]-3-phenyl-, 3-(Phenyl)-4-(4-(methylsulfonyl)phenyl)-2-(5H)-furanone, 3-Phenyl-4-(4-(Methylsulfonyl)Phenyl)-2-(5H)-Furanone, 4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofuran-2-one, Vioxx; 4-[4-(Methylsulfonyl)phenyl]-3-phenylfuran-2(5H)-one


ID: 2049

chemical graph of compound 2049



InChIKey: RZRPTBIGEANTGU-IRIMSJTPSA-N
SMILES: C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CCC4=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 223997
synonyms found at PubChem are:
ADRENOSTERONE, 382-45-6, Androst-4-ene-3,11,17-trione, Reichstein's substance G, Andrenosterone, 11-Oxy-4-androstenedione, 11-Oxoandrostenedione, 4-Androstene-3,11,17-trione, 11-Ketoandrostenedione, 11-Keto-androstenedione, UNII-AE4E9102GY, 11-OXO, NSC 12166, MLS000028712, AE4E9102GY, CHEBI:2495, RZRPTBIGEANTGU-IRIMSJTPSA-N, 11-oxoandrost-4-ene-3,17-dione, SMR000059216, 17-Ketosteroid, 4-Androsten-3,11,17-trione, adrenoterone, Adrenosteron, EINECS 206-843-2, Adrenosterone, 98%, AC1L5CYX, Opera_ID_1090, Prestwick0_000899, Prestwick1_000899, Prestwick2_000899, Prestwick3_000899, bmse000522, BSPBio_000718, MLS001146874, Androst-4-ene-3,17-trione, SCHEMBL329751, SPBio_002927, BPBio1_000790, CHEMBL485683, CTK1C2623, MolPort-002-070-296, 11-oxo4-androstene-3,17-dione, HMS1570D20, HMS2097D20, HMS2231O24, HMS3714D20, NSC12166, ZINC4096672, ANW-43469, NSC-12166, AKOS015919184, ACN-032044, CCG-220899, CS-1756, NCGC00179466-01, 911474-75-4, HY-17462, TL8002799, TR-031599, AB00513953, C05285, SR-01000721947, Q-200602, SR-01000721947-3, BRD-K17368287-001-03-5, 793B9701-82B7-46F0-BDC7-04C33B82723A, (1S,2R,10S,11S,15S)-2,15-dimethyltetracyclo[8.7.0.0;{2,7}.0;{11,15}]heptadec-6-ene-5,14,17-trione, (8S,9S,10R,13S,14S)-10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-trione, 2,5,8(6H)-Chrysenetrione, 7-((acetyloxy)methyl)-3,4,4a,4b,6a,7,9,10,10a,10b,11,12-dodecahydro-7-hydroxy-4a,6a-dimethyl-, (4aR,4bS,6aS,7R,10aS,10bS)-, 293738-14-4


ID: 2050

chemical graph of compound 2050



InChIKey: RZTAMFZIAATZDJ-UHFFFAOYSA-N
SMILES: CCOC(=O)C1=C(NC(=C(C1C2=C(C(=CC=C2)Cl)Cl)C(=O)OC)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3333
synonyms found at PubChem are:
felodipine, 72509-76-3, Plendil, Flodil, Renedil, Feloday, Munobal, Splendil, dl-Felodipine, Perfudal, Prevex, Hydac, Modip, Agon, Felodipina, Plendil ER, Felodipinum, Felogard, Penedil, Preslow, Munobal Retard, Plendil Retard, Plendil Depottab, Lexxel, Felodipinum [INN-Latin], Felodipina [INN-Spanish], Felodur ER, AGON SR, Plandil, 3-ethyl 5-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, Felodipine [USAN:BAN:INN], Logimax, 86189-69-7, C18H19Cl2NO4, Plendil (TN), Felodipine [USAN:INN:BAN], Felodipine (Plendil), H 154/82, BRN 4331472, H-154/82, Felodipine (JAN/USP/INN), (+-)-Ethyl methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, MLS000069629, CGH-869, CHEBI:585948, RZTAMFZIAATZDJ-UHFFFAOYSA-N, H 154-82, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylic acid ethyl methyl ester, 5-O-ethyl 3-O-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, 3,5-Pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-, ethyl methyl ester, NCGC00015455-03, SMR000058204, DSSTox_CID_3042, F 9677, 3-Ethyl 5-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate, 4-(2,3-Dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinecarboxylic acid ethyl methyl ester, DSSTox_RID_76848, ethyl methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, DSSTox_GSID_23042, AE-641/11429675, Felobeta, Felocor, Felodur, Felogamma, Fensel, Felodipin dura, Felo Biochemie, Felodipin Stada, Felodipin AbZ, Felo Puren, Felo-Puren, felodipin von ct, Felodipin AZU, Felodipin Heumann, Ethyl methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, O5-ethyl O3-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, Heumann, Felodipin, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2,3-dichlorophenyl)-2,6-dimethyl-, ethyl methyl ester, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2,3-dichlorophenyl)-2,6-dimethyl-,ethyl methyl ester, 3,5-Pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-, ethyl methyl ester, (+-)-, 4-(2,3-dichloro-phenyl)-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid 3-ethyl ester 5-methyl ester, Felodipin ratiopharm, Felodipin-ratiopharm, (R)-(+)-Felodipine, (S)-(-)-Felodipine, Felodipin 1A Pharma, SR-01000075890, FelodurER, Felodipine, solid, Felodipine,(S), (RS)-Felodipine, Felodipine [USAN:USP:INN:BAN], 3,5-dicarboxylate, Prestwick_797, CAS-72509-76-3, (+/-)-felodipine, Felodipine (dl form), PubChem15919, Renedil;Feloday;Plendil, BC Brand of Felodipine, 1A Brand of Felodipine, AbZ Brand of Felodipine, Opera_ID_1873, Prestwick0_000478, Prestwick1_000478, Prestwick2_000478, Prestwick3_000478, (.+/-.)-Felodipine, Aliud Brand of Felodipine, Astra Brand of Felodipine, Hexal Brand of Felodipine, D0WN0U, Promed Brand of Felodipine, Worwag Brand of Felodipine, AC1L1FP2, AC1Q32PZ, Aventis Brand of Felodipine, Heumann Brand of Felodipine, Hoechst Brand of Felodipine, Alpharma Brand of Felodipine, CHEMBL1480, H 15482, Lopac0_000508, SCHEMBL26398, betapharm Brand of Felodipine, BSPBio_000616, Azupharma Brand of Felodipine, MLS001077361, MLS001333735, MLS002153409, MLS002153832, MLS003876820, BIDD:GT0733, ratiopharm Brand of Felodipine, Alphapharm Brand of Felodipine, H 154 82, SPBio_002555, Stadapharm Brand of Felodipine, TheraPharm Brand of Felodipine, Merck dura Brand of Felodipine, AstraZeneca Brand of Felodipine, BPBio1_000678, GTPL4190, CHEMBL3196476, DTXSID4023042, SCHEMBL13460298, CTK8B3303, MolPort-002-801-136, BDBM189379, HMS1569O18, HMS2089J05, HMS2096O18, HMS2232D24, HMS3259F12, HMS3261F17, HMS3651O21, HMS3713O18, Pharmacia Spain Brandof Felodipine, Pharmakon1600-01505887, 105618-03-9, 119945-59-4, BCP02192, ct Arzneimittel Brand of Felodipine, ct-Arzneimittel Brand of Felodipine, HY-B0309, KS-000001QR, 2,6-dimethyl-1,4-dihydropyridine-, Tox21_110155, Tox21_500508, ANW-42236, MFCD00868316, NSC760343, s1885, AKOS015891545, Plendil, Renedil, Feloday, Felodipine, Tox21_110155_1, AC-2124, BCP9000680, CCG-204599, CS-2348, DB01023, KS-1264, LP00508, MCULE-8253440089, NC00721, NSC-760343, Pharmaceutica Astra Brand of Felodipine, ( inverted exclamation markA)-Felodipine, NCGC00015455-04, NCGC00015455-05, NCGC00015455-06, NCGC00015455-07, NCGC00015455-08, NCGC00015455-10, NCGC00024087-02, NCGC00093906-01, NCGC00093906-02, NCGC00261193-01, AC-24403, AN-14248, AN-35618, BC203911, CPD002529504, K235, KB-51851, SAM002589971, SC-12116, SMR002529504, AB0014113, AB2000349, LS-131202, 3-ethyl 5-methyl 4-(2,3-dichlorophenyl)-, EU-0100508, F0814, FT-0626393, FT-0660933, EN300-70726, D00319, S-8162, 509F763, 72509-76-3 pound>>86189-69-7, I14-9560, SR-01000075890-1, SR-01000075890-4, BRD-A30815329-001-03-0, Z239864852, Felodipine, European Pharmacopoeia (EP) Reference Standard, Felodipine, United States Pharmacopeia (USP) Reference Standard, (+/-) ethyl methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, (+/-)-ethylmethyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, (.+/-.) Ethyl methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2,3-dichlorophenyl)-2,6-dimethyl-, ethyl methylester, 3,5-pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-,ethyl methyl ester, (+-)-, 3-Ethyl 5-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate #, 4-(2,3-DICHLOROPHENYL)-1,4-DIHYDRO- 2,6-DIMETHYL-3,5-PYRIDINEDICARBOXYLIC ACID ETHYL METHYL ESTER, Ethyl methyl (4RS)-4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate


ID: 2051

chemical graph of compound 2051



InChIKey: RZVAJINKPMORJF-UHFFFAOYSA-N
SMILES: CC(=O)NC1=CC=C(C=C1)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 1983
synonyms found at PubChem are:
acetaminophen, Paracetamol, 4-Acetamidophenol, 103-90-2, Tylenol, N-(4-Hydroxyphenyl)acetamide, APAP, Acetaminofen, Panadol, Datril, p-Acetamidophenol, p-Hydroxyacetanilide, Algotropyl, N-Acetyl-p-aminophenol, Lonarid, Naprinol, 4'-Hydroxyacetanilide, p-Acetaminophenol, Acamol, Acenol, Anelix, Multin, Abensanil, Acetagesic, Acetalgin, Clixodyne, Gelocatil, Injectapap, Liquagesic, Pyrinazine, Servigesic, Alvedon, Anaflon, Apamide, Dymadon, Febridol, Febrilix, Febrolin, Finimal, Homoolan, Lestemp, Paracet, Tabalgin, Tralgon, Tussapap, Valadol, Valgesic, Alpiny, Amadil, Anhiba, Calpol, Dirox, Eneril, Fendon, Hedex, Lyteca, Pacemo, Panets, Parmol, Tapar, Tempra, Paracetamolo, Doliprane, Dolprone, Momentum, Ortensan, Paldesic, Acephen, Banesin, Captin, Disprol, Enelfa, Neopap, Salzone, Exdol, p-Acetylaminophenol, Febro-Gesic, NEBS, Acetamide, N-(4-hydroxyphenyl)-, Paracetamolum, Biocetamol, Dafalgan, Dolgesic, Elixodyne, Febrectal, Tempanal, Vermidon, Abenol, Apacet, Apadon, Cetadol, Fensum, Janupap, Minoset, Napafen, Neodol, Nobedon, Pacemol, Panodil, Parapan, Pedric, Phendon, Rounox, Suppap, Korum, Pinex, Temlo, 4-(Acetylamino)phenol, Ben-u-ron, Dial-A-Gesic, Anacin-3, Calmanticold, Codoliprane, Demogripal, Dolegrippin, Doloreduct, Dristancito, Duracetamol, Eu-Med, Grippostad, Gynospasmine, Medocodene, Paedialgon, Paracetanol, Parakapton, Pediapirin, Phenipirin, Phogoglandin, Predualito, Sanicopyrine, Scentalgyl, Sunetheton, Tachiprina, Termalgine, Treuphadol, Abrolet, Acertol, Acetaco, Acetamol, Acetofen, Afebrin, Afebryl, Aferadol, Algesidal, Algomol, Alpinyl, Analter, Antidol, Apitrelal, Atralidon, Babikan, Bacetamol, Cadafen, Calapol, Causalon, Cefalex, Codabrol, Codalgin, Codapane, Codicet, Codisal, Cofamol, Cosutone, Cuponol, Curadon, Custodial, Darocet, Daygrip, Deminofen, Democyl, Desfebre, Dimindol, Dolefin, Dolofugin, Dolorfug, Dolorstop, Dolotec, Dorocoff, Dularin, Durapan, Ecosetol, Excipain, Fanalgic, Farmadol, Febranine, Febrectol, Febricet, Febrinol, Fepanil, Finiweh, Fluparmol, Geluprane, Ildamol, Inalgex, Infadrops, Kataprin, Labamol, Lekadol, Lemgrip, Lupocet, Magnidol, Malidens, Maxadol, Mexalen, Minafen, Miralgin, Nealgyl, Neodolito, Neotrend, Neuridon, Nodolex, Oralgan, Oxycocet, Pacimol, Panacete, Panadeine, Panadiene, Panaleve, Panamax, Panasorbe, Panofen, Pantalgin, Paracemol, Paracenol, Paracetol, Paracin, Paracod, Paracodol, Parador, Paradrops, Paralen, Paralief, Paralink, Paralyoc, Paramol, Paramolan, Paranox, Parasedol, Parasin, Paraspen, Parcetol, Parogal, Pediatrix, Phenaphen, Piramin, Pirinasol, Polmofen, Predimol, Prontina, Puernol, Pulmofen, Pyrigesic, Pyromed, Remedol, Rivalgyl, Rubophen, Rupemol, Sanicet, Schmerzex, Sedalito, Semolacin, Seskamol, Setakop, Setamol, Sifenol, Sinaspril, Sinedol, Stanback, Stopain, Supofen, Tazamol, Termacet, Termalgin, Termofren, Titralgan, Tricoton, Upsanol, Utragin, Veralgina, Viruflu, Vivimed, Zatinol, Abrol, Algina, Anapap, Andox, Arfen, Asetam, Asomal, Aspac, Asplin, Benmyo, Curpol, Dhamol, Dolcor, Dolko, Dresan, Dypap, Febrex, Febrin, Lemsip, Malgis, Noral, Oltyl, Paceco, Pacet, Paedol, Painex, Pamol, Panex, Parake, Paroma, Plicet, Prodol, Reliv, Scanol, Setol, Sinmol, Tiffy, Tylex, Tylol, Tymol, Verpol, Volpan, Zolben, NeoCitran, NilnOcen, Nina, RubieMol, Vips, Supadol mono, Treupel mon, Bickie-mol, Fortalidon P, Gattaphen T, Gripin Bebe, Influbene N, Lonarid Mono, Lyteca Syrup, Panadeine Co, Dymadon Co, Toximer P, Treupel N, Accu-Tap, 4-Acetaminophenol, Helon N, Malex N, Spalt N, Tylex CD, acetaminophene, N-Acetyl-4-aminophenol, SK-Apap, Paracetamole, Aminofen, Conacetol, Darvocet, Empracet, Panasorb, Perfalgan, A-Per, Apamid, Atasol, Duaneo, Duorol, Ofirmev, Parelan, Prompt, Vicodin, 4-Hydroxyacetanilide, Fevor, Freka-cetamol, NAPAP, Codisal Forte, Croix Blanche, Dolorol Forte, Dymadon Forte, Junior Disprol, Kinder Finimal, Liquigesic Co, Mono Praecimed, Percocet-Demi, Perdolan Mono, Rockamol Plus, Viclor Richet, Actifed Plus, Kratofin simplex, Neo-Fepramol, Paracetamol AL, Paracetamol BC, Paracetamol DC, Paracetamol PB, Acetanilide, 4'-hydroxy-, Claradol Codeine, Geralgine-P, Melabon Infantil, Migraleve Yellow, Paracetamol Saar, Pyregesic-C, Anti-Algos, Para-Suppo, Pasolind N, Supramol-M, Fever All, No-Febril, Panado-Co, Para-Tabs, Paracetamol Hexal, Paracetamol Raffo, Paracetamol Rosch, Paracetamol Stada, Dol-Stop, Anadin dla dzieci, p-Hydroxyphenolacetamide, Percocet-5, Cod-Acamol Forte, Contra-Schmerz P, Hy-Phen, Medinol Paediatric, Paracetamol Basics, Panado-Co Caplets, Paracetamol von ct, Pe-Tam, Paracetamol Fecofar, Paracetamol Harkley, Paracetamol Heumann, Paracetamol Nycomed, Codral Pain Relief, Paracetamol Hanseler, Paracetamol Winthrop, Phenaphen W/Codeine, Spalt fur die nacht, A.F. Anacin, Capital with Codeine, Acetominophen, Paracetamol Genericon, Actamin, Anexsia, Butapap, Demilets, Endecon, Intensin, Naldegesic, Pasolind, Phrenilin, Redutemp, Resfenol, Robigesic, Sedapap, Theraflu, Triaprin, Tycolet, Valorin, Wygesic, Tencon, Allay, Bucet, Norco, Paracetamol Ratiopharm, Coricidin Sinus, Phrenilin Forte, Paracetamol Italfarmaco, Sudafed Sinus, Aceta Elixir, Coricidin D, Dafalgan Codeine, Quiet World, Paracetamol Antipanin P, St Joseph Aspirin-Free, Co-Gesic, Jin Gang, New Cortal for Children, INFANTS' FEVERALL, Synalgos-Dc-A, 4-acetylaminophenol, St. Joseph Fever Reducer, Midol Teen Formula, Paracetamol Dr. Schmidgall, Acetamide, N-(p-hydroxyphenyl)-, Aspirin-Free Anacin, Propacet 100, Children's Tylenol Chewable, NCI-C55801, Proval #3, PCM Paracetamol Lichtenstein, Dolene AP-65, Tylenol Allergy Sinus, p-(Acetylamino)phenol, Rhinex D-Lay Tablets, acetaminophenol, Midol Regular Strength, Paracetamol SmithKline Beecham, Scherzatabletten Rezeptur 534, Acetavance, Arthralgen, Paracetamolo [Italian], Percogesic with Codeine, Actimol, Anuphen, Calonal, Capital, Excedrin, Genapap, Liqiprine, Robitussin Night Relief, Tapanol, 4-Hydroxyanilid kyseliny octove, Acenol (pharmaceutical), Bayer Select Head Cold, Genebs, N-(4-Hydroxyphenyl)acetanilide, Drixoral Sinus, Aceta Tablets, D oliprane, Drixoral Plus, Valorin Extra, Bayer Select, NCX 701, Panale ve, Paracetamol [INN:BAN], Ty lenol, CCRIS 3, Snaplets-FR, Oraphen-PD, Phenaphen Caplets, Bayer Select Allergy-Sinus, Bayer Select Headache Pain, Dristan Cold No Drowsiness, Paracetamolum [INN-Latin], Sudafed Severe Cold Formula, Prestwick_13, St Joseph Aspirin-Free for Children, UNII-362O9ITL9D, Children's Acetaminophen Elixir Drops, Children's Acetaminophen Oral Solution, Midol PM Night Time Formula, Tavist Allergy/Sinus/Headache, Triaminic Sore Throat Formula, Dapa X-S, Bayer Select Sinus Pain Relief, Drixoral Cold & Flu, Phenol, p-acetamido-, Sine-Off Sinus Medicine Caplets, CHEBI:46195, HSDB 3001, Roxicet 5/500, RZVAJINKPMORJF-UHFFFAOYSA-N, Tocris-1706, Contac Cough & Sore Throat Formula, N-acetyl-para-aminophenol, 4-(N-Acetylamino)phenol, Acetaminophen (4-hydroxyacetanilide), Bayer Select Menstrual Multi-Symptom, EINECS 203-157-5, 222 AF, n-acetyl-4-hydroxyaniline, St. Joseph Cold Tablets for Children, CHEMBL112, NSC 109028, 4-Hydroxyanilid kyseliny octove [Czech], Children's Acetaminophen Elixir Solution, N-(4-hydroxyphenyl)-acetamide, 362O9ITL9D, ANEXSIA 10/660, component of Dialog, component of Dilone, component of Endecon, component of Percocet, component of Phenaphen, TYL, N-(4-Hydroxyphenyl)acetamide (Tylenol), component of Percogesic, DSSTox_CID_6, NCGC00016361-07, CAS-103-90-2, WLN: QR DMV1, DSSTox_RID_75318, DSSTox_GSID_20006, component of Hycomine Compound, Flexsure, Tylenol (caplet), Tylenol (geltab), Tylenol 8-Hour, Anacin 3, SMR000112065, Acetaminophen [USP], SR-01000597517, Acetaminophen [USP:JAN], paracetamol (acetaminophen), acetominophene, Claratal, Daphalgan, Resprin, Calpol infant, Daga, Apacet Capsules, Atasol Caplets, Atasol Tablets, Tempra Caplets, Tylenol Caplets, Tylenol Elixir, Tylenol Gelcaps, Tylenol Tablets, Actamin Extra, Actamin Super, Aminofen Max, Apacet Elixir, Atasol Drops, Exdol Strong, p-Acetoaminophen, Tempra Drops, Tempra Syrup, Tylenol Drops, alpha-Per, Citramon P, Excedrin Caplets, Papa-Deine, Dial-alpha-gesic, Apo-Acetaminophen, 4-acetominophenol, Genebs X-Tra, 4-acetamido phenol, 4-acetamido-phenol, Tempra D.S, 4-Acetamino phenol, APAP, Paracetamol, Aspirin free anacin, Acetaminophen 650, acetyl-p-aminophenol, p-hydroxy-acetanilid, p-hydroxyacetoanilide, Paracetamol (INN), Proxyphene/Acetamine, Tylenol (TN), Supac (Salt/Mix), Tylox (Salt/Mix), Zydone (Salt/Mix), Atasol Forte Caplets, Atasol Forte Tablets, Atasol Oral Solution, para-acetylaminophenol, Anexsia (Salt/Mix), Endecon (Salt/Mix), Sinubid (Salt/Mix), Talacen (Salt/Mix), Vicodin (Salt/Mix), Wygesic (Salt/Mix), Acetaminophen Uniserts, Datril Extra-Strength, Tylenol Infants Drops, Demilets (Salt/Mix), Empracet (Salt/Mix), Intensin (Salt/Mix), Propacet (Salt/Mix), Suppap-120, Suppap-325, Suppap-650, Panadol Extra Strength, TheraFlu (Salt/Mix), Coricidin (Salt/Mix), Liquiprin (Salt/Mix), Hy-Phen (Salt/Mix), IV-APAP, phenol derivative, 11, PubChem17726, Spectrum_000016, Tempra Chewable Tablets, Naldegesic (Salt/Mix), Actimol Chewable Tablets, Feverall Junior Strength, Darvocet-N (Salt/Mix), AC1L1CNW, AC1Q1KYJ, AC1Q1KYK, Anacin-3 Extra Strength, Liquiprin Infants" Drops, N-acetyl para aminophenol, Prestwick0_000868, Prestwick1_000868, Prestwick2_000868, Prestwick3_000868, Spectrum2_000085, Spectrum3_000283, Spectrum4_000140, Spectrum5_000736, Coricidin D (Salt/Mix), Quiet World (Salt/Mix), Genapap Children's Elixir, Tylenol Children's Elixir, 4-Acetamidophenol, 98%, Actifed Plus (Salt/Mix), D0U5QK, D0U9NY, Epitope ID:117710, Genapap Children's Tablets, Sudafed Sinus (Salt/Mix), EC 203-157-5, Actimol Infants' Suspension, Drixoral Sinus (Salt/Mix), Liquiprin Children's Elixir, N-acetyl-4-hydroxyaniline;, SCHEMBL3480, Acetaminophen (JP17/USP), Coricidin Sinus (Salt/Mix), BSPBio_000915, BSPBio_001786, DDS-06A, KBioGR_000560, KBioSS_000356, 4-13-00-01091 (Beilstein Handbook Reference), Actimol Children's Suspension, Apacet Extra Strength Caplets, Apacet Extra Strength Tablets, Aspirin-Free Excedrin Caplets, Genebs Extra Strength Caplets, KSC492K1N, MLS001146925, MLS001331684, MLS002154041, BIDD:GT0005, DivK1c_000660, N-(4-hydroxyphenyl)ethanamide, SPECTRUM1500101, Genapap Extra Strength Caplets, Genapap Extra Strength Tablets, SPBio_000010, SPBio_002836, Tapanol Extra Strength Caplets, Tapanol Extra Strength Tablets, Tylenol Extra Strength Caplets, Tylenol Extra Strength Gelcaps, Tylenol Extra Strength Tablets, ACMC-20989w, Actimol Junior Strength Caplets, Apacet Regular Strength Tablets, BPBio1_001007, Excedrin Extra Strength Caplets, Genebs Regular Strength Tablets, GTPL5239, Panadol Junior Strength Caplets, SGCUT00014, Tylenol Junior Strength Caplets, Midol Teen Formula (Salt/Mix), DTXSID2020006, Genapap Regular Strength Tablets, Panadol Maximum Strength Caplets, Panadol Maximum Strength Tablets, SCHEMBL19474893, Tylenol Regular Strength Caplets, Tylenol Regular Strength Tablets, Aspirin-Free Anacin (Salt/Mix), BDBM26197, CTK3J2516, HMS502A22, KBio1_000660, KBio2_000356, KBio2_002924, KBio2_005492, KBio3_001286, EBD5728, NSC3991, Tylenol Arthritis Extended Relief, Acetaminophen, analytical standard, MolPort-000-150-777, NINDS_000660, Tylenol Infants" Suspension Drops, BCPP000441, Drixoral Cold & Flu (Salt/Mix), HMS1570N17, HMS1920A03, HMS2091G03, HMS2097N17, HMS2269G20, HMS3268A10, HMS3714N17, LS-32, Pharmakon1600-01500101, Tylenol Allergy Sinus (Salt/Mix), Midol Regular Strength (Salt/Mix), ACT06727, BCP23431, KS-000002NN, NSC 3991, NSC-3991, STR00901, to_000023, Tylenol Children's Chewable Tablets, Acetaminophen, BioXtra, >=99.0%, Bayer Select Head Cold (Salt/Mix), Robitussin Night Relief (Salt/Mix), Tox21_110397, Tox21_201930, Tox21_300100, ANW-14994, BBL005229, CCG-38901, MFCD00002328, NSC109028, NSC755853, SBB043758, STL140694, Tylenol Children's Suspension Liquid, ZINC13550868, AKOS000121004, Feverall Sprinkle Caps Junior Strength, Ornex Severe Cold Formula (Salt/Mix), Tox21_110397_1, Bayer Select Allergy-Sinus (Salt/Mix), BCP9000225, CS-2819, DB00316, MCULE-3844920617, NSC-109028, NSC-755853, RP21489, RTR-000905, TRA0127672, IDI1_000660, Sine-Aid, Maximum Strength (Salt/Mix), Sudafed Severe Cold Formula (Salt/Mix), NCGC00016361-01, NCGC00016361-02, NCGC00016361-03, NCGC00016361-04, NCGC00016361-05, NCGC00016361-06, NCGC00016361-08, NCGC00016361-09, NCGC00016361-10, NCGC00016361-12, NCGC00016361-13, NCGC00025267-01, NCGC00025267-02, NCGC00025267-03, NCGC00025267-04, NCGC00025267-05, NCGC00253912-01, NCGC00259479-01, Tylenol Junior Strength Chewable Tablets, 8055-08-1, AC-23969, AJ-70539, AN-24662, BC204766, CJ-15887, H865, HY-66005, KB-74449, Midol PM Night Time Formula (Salt/Mix), SC-19146, Triaminic Sore Throat Formula (Salt/Mix), BCP0726000305, SBI-0051269.P003, AB1009347, Bayer Select Sinus Pain Relief (Salt/Mix), KB-188932, KB-192758, TR-000905, AB00051905, Aspirin Free Anacin Maximum Strength Caplets, Aspirin Free Anacin Maximum Strength Tablets, FT-0658035, Sine-Off Sinus Medicine Caplets (Salt/Mix), ST24028862, ST45179777, Unavailable - See ASDI_CatNo 500008847, 6473-EP1441224A2, 6473-EP2270008A1, 6473-EP2272832A1, 6473-EP2275420A1, 6473-EP2277565A2, 6473-EP2277566A2, 6473-EP2277567A1, 6473-EP2277568A2, 6473-EP2277569A2, 6473-EP2277570A2, 6473-EP2277861A1, 6473-EP2277865A1, 6473-EP2277875A2, 6473-EP2280008A2, 6473-EP2281559A1, 6473-EP2281819A1, 6473-EP2281823A2, 6473-EP2292280A1, 6473-EP2292617A1, 6473-EP2292619A1, 6473-EP2298764A1, 6473-EP2298765A1, 6473-EP2305219A1, 6473-EP2305654A1, 6473-EP2305659A1, 6473-EP2308510A1, 6473-EP2308872A1, 6473-EP2311818A1, 6473-EP2314585A1, 6473-EP2314590A1, 6473-EP2316829A1, 6473-EP2371811A2, C06804, D00217, 72238-EP2305640A2, 72238-EP2308867A2, 72238-EP2308870A2, 91399-EP2277876A1, 91399-EP2284149A1, 91399-EP2292614A1, 91399-EP2305636A1, AB00051905-09, AB00051905_10, Aspirin Free Anacin Maximum Strength Gel Caplets, Bayer Select Menstrual Multi-Symptom (Salt/Mix), Contac Cough & Sore Throat Formula (Salt/Mix), L024125, St. Joseph Cold Tablets for Children (Salt/Mix), Tylenol Extra Strength Adult Liquid Pain Reliever, I05-0086, J-001064, J-514275, Paracetamol (Acetaminophen) 1.0 mg/ml in Methanol, SR-01000597517-1, SR-01000597517-2, SR-01000597517-4, BRD-K41524689-001-08-6, F3096-1731, F48B493F-B1FD-410C-AA0A-F40EC71A0689, Bayer Select Maximum Strength Headache Pain Relief Formula, Paracetamol, British Pharmacopoeia (BP) Reference Standard, Paracetamol, European Pharmacopoeia (EP) Reference Standard, Acetaminophen solution, drug standard, 1.0 mg/mL in methanol, Acetaminophen, United States Pharmacopeia (USP) Reference Standard, Acetaminophen, meets USP testing specifications, 98.0-102.0%, powder, Acetaminophen, Pharmaceutical Secondary Standard; Certified Reference Material, InChI=1/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10, Paracetamol for equipment qualification, EuropePharmacopoeia (EP) Reference Standard, 1430221-00-3, 4 inverted exclamation marka-Hydroxyacetanilide; 4-Acetamidophenol; N-Acetyl-4-aminophenol; APAP, 719293-04-6, Tylenol (USA), Anacin Aspirin Free (USA), Apra (USA), Crocin (India), Feverall (USA), Genapap (USA), Panadol (UK), Panamax (Australia), Panodil (Denmark)


ID: 2052

chemical graph of compound 2052



InChIKey: RZVHIXYEVGDQDX-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6780
synonyms found at PubChem are:
ANTHRAQUINONE, 9,10-Anthraquinone, 84-65-1, anthracene-9,10-dione, 9,10-Anthracenedione, Anthradione, Hoelite, 9,10-Dioxoanthracene, Corbit, Morkit, 9,10-Anthrachinon, Anthra-9,10-quinone, Anthrapel, 9,10-quinone, Az-Q, Anthrachinon, Caswell No. 052A, Anthraquinone [BSI:ISO], UNII-030MS0JBDO, Bis-alkylamino anthraquinone, NSC 7957, 9,10-Anthrachinon [Czech], CCRIS 649, 9,10-Anthracendion, Anthracene, 9,10-dihydro-9,10-dioxo-, CHEBI:40448, HSDB 2074, EINECS 201-549-0, Anthracene-9,10-quinone, EPA Pesticide Chemical Code 122701, 030MS0JBDO, CHEMBL55659, AI3-09073, RZVHIXYEVGDQDX-UHFFFAOYSA-N, 9,10-dihydro-9,10-dioxoanthracene, NCGC00094960-03, DSSTox_CID_95, DSSTox_RID_75364, DSSTox_GSID_20095, CAS-84-65-1, Morkie, Anthracenequinone, 9,10-anthrachinoe, 9,10-Anthraguinone, Anthraquinone, 97%, Spectrum_001527, SpecPlus_000645, AC1L1NAG, Spectrum2_000405, Spectrum3_001501, Spectrum4_000907, Spectrum5_001897, ACMC-209pw0, Anthra-9,10-quinone #, D0L5LN, Epitope ID:116191, EC 201-549-0, AC1Q6JY1, SCHEMBL14943, BSPBio_003141, KBioGR_001374, KBioSS_002007, KSC362C5J, DivK1c_006741, SPECTRUM1502103, SPBio_000330, DTXSID3020095, KBio1_001685, KBio2_002007, KBio2_004575, KBio2_007143, KBio3_002641, NSC7957, Anthraquinone, analytical standard, MolPort-001-783-170, HMS1921J14, NSC-7957, ZINC3847491, Tox21_111369, 9,10-dihydroanthracene-9,10-dione, ANW-37822, BBL003001, BDBM50094892, CCG-39966, MFCD00001188, SBB060613, STK398385, Anthracene,10-dihydro-9,10-dioxo-, AKOS000282964, Tox21_111369_1, DS-4810, LS-1837, MCULE-4655011423, RP26414, RTR-031315, TRA0074021, NCGC00094960-01, NCGC00094960-02, NCGC00094960-04, NCGC00094960-06, AC-12719, AJ-45864, AN-24075, K513, KB-74706, SC-46775, Anthraquinone, purum, >=99.0% (HPLC), DB-005409, TR-031315, A0502, Anthraquinone 100 microg/mL in Acetonitrile, FT-0622417, ST24024605, ST50410412, T8216, Anthraquinone, Vetec(TM) reagent grade, 97%, C16207, Anthraquinone, PESTANAL(R), analytical standard, AB-131/40003277, SR-01000944707, I14-1219, SR-01000944707-1, BRD-K15957397-001-03-4, Melting point standard 283-286C, analytical standard, F0001-2133, Melting point standard 283-286 inverted exclamation markaC, InChI=1/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8


ID: 2053

chemical graph of compound 2053



InChIKey: SAOOBRUHTPONGX-CDKFMWKUSA-N
SMILES: CC1=C2CC=C3[C@](C2=CC(=C1OC(=O)C)OC(=O)C)(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4C[C@](CC5)(C)C(=O)O)C)C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 9828620
synonyms found at PubChem are:
Dihydrocelastryl diacetate, BDBM81366, MolPort-044-811-219, 2,3-Diacetoxy-24-norfriedelane-1(10),2,4,7-tetraene-29-oic acid


ID: 2054

chemical graph of compound 2054



InChIKey: SARMGXPVOFNNNG-UHFFFAOYSA-N
SMILES: CC(C)N=C(N)/N=C(\N)/NC1=CC=C(C=C1)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 12498
synonyms found at PubChem are:
AC1L1ZQ3, MLS002154090, SARMGXPVOFNNNG-UHFFFAOYSA-N, SMR001233398, FT-0664524, Z1558572526, 1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine hydrochloride, 1-({amino[(4-chlorophenyl)amino]methylidene}amino)-N'-(propan-2-yl)methanimidamide hydrochloride, Chloroguanidine, hydrochloride, WLN: GR DMYUM&MYUM&MY1&1 &GH, Paludrine hydrochloride, NSC12977, AC1NSE0V, NSC26614, NSC-12977, NSC-26614, (1Z)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine hydrochloride, Proguanil hydrochloride, 637-32-1, Diguanyl, Paludrine, Chlorguanide hydrochloride, Chloroquanil, Bigumalum, Chloroguanide hydrochloride, Proguanil HCl, Tirian hydrochloride, Palusil hydrochloride, Drinupal hydrochloride, Guanatol hydrochloride, 1-(p-Chlorophenyl)-5-isopropylbiguanide hydrochloride, Chloroguanidine hydrochloride, UNII-R71Y86M0WT, Bigumal, EINECS 211-283-7, NSC 12977, NSC 26614, 3359 RP, SN 12,837, R71Y86M0WT, 336U50, M 4888, N-4-Chlorophenyl-N(sup 5)-isopropyldiguanide hydrochloride, Chloroguanide HCl, N-(4-Chlorophenyl)-N(sup5)-isopropyldiguanide hydrochloride, Paludrine (TN), BIGUANIDE, 1-(p-CHLOROPHENYL)-5-ISOPROPYL-, MONOHYDROCHLORIDE, DSSTox_CID_27756, DSSTox_RID_82533, DSSTox_GSID_47776, W-109585, 1-(4-chlorophenyl)-5-isopropylbiguanide hydrochloride, N1-(4-Chlorophenyl)-N5-isopropylbiguanide, N-(4-Chlorophenyl)-N'-(1-methylethyl)-imidodicarbonimidic Diamide Hydrochloride, NCGC00016528-01, CAS-637-32-1, SR-05000001973, 1-(4-chlorophenyl)-3-(N-propan-2-ylcarbamimidoyl)guanidine;hydrochloride, Proguanil chloride, Proguanil hydrochloride [USAN:USP], C11H16ClN5.HCl, GWAH7673A, SCHEMBL218859, Proguanil hydrochloride (JAN), C11H17Cl2N5, AMBZ0378, GW AH7673A, 500-92-5 (Parent), CHEMBL1201059, DTXSID7047776, MolPort-003-666-543, HMS1571G19, Pharmakon1600-01504211, Atovaquone, Proguanil Hydrochloride, Tox21_110476, CCG-39555, GL3057, MFCD01732193, NSC758688, AKOS024255720, Tox21_110476_1, AM85857, API0004822, HS-0102, NSC-758688, QC-1853, Imidodicarbonimidic diamide, N-(4-chlorophenyl)-N'-(1-methylethyl)-, monohydrochloride, NCGC00016528-05, LS-43874, Proguanil hydrochloride, >=95% (HPLC), AB0095163, KB-276270, X3488, D02487, M-4888, N1-(4-Chlorophenyl)-N5-isopropylbiguanide HCl, 637P321, SR-05000001973-3, Proguanil hydrochloride, European Pharmacopoeia (EP) Reference Standard, Proguanil hydrochloride, United States Pharmacopeia (USP) Reference Standard, (1E)-1-[amino-[(4-chlorophenyl)amino]methylidene]-2-propan-2-ylguanidine hydrochloride, Proguanil for system suitability, European Pharmacopoeia (EP) Reference Standard, Proguanil hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material, Imidodicarbonimidic diamide, N-(4-chlorophenyl)-N'-(1-methylethyl)-, monohydrochloride (9CI), 1-(4-chlorophenyl)-2-(N-propan-2-ylcarbamimidoyl)guanidine


ID: 2055

chemical graph of compound 2055



InChIKey: SASVNKPCTLROPQ-NZYDNVMFSA-N
SMILES: CC(=O)O[C@@H]1[C@H]2COC(=O)[C@@H]2[C@@H](C3=CC4=C(C=C13)OCO4)C5=CC(=C(C(=C5)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 164791
synonyms found at PubChem are:
Podophyllotoxin acetate, Acetylpodophyllotoxin, 1180-34-3, Acetyl podophyllotoxin, Podophyllotoxin, acetate, Podophyllin Acetate, NSC 36408, Spectrum_001858, Spectrum2_001681, Spectrum3_001672, Spectrum4_001662, Spectrum5_000563, AC1L4VH1, BSPBio_003483, KBioGR_002183, KBioSS_002375, SCHEMBL985502, SPECTRUM1504412, SPBio_001602, CHEMBL1409147, Podophyllotoxin, acetate (8CI), CTK4B0543, KBio2_002371, KBio2_004939, KBio2_007507, KBio3_002703, DTXSID90151999, NSC36408, ZINC4164766, CCG-38772, NSC-36408, SDCCGMLS-0066778.P001, NCGC00161925-01, NCGC00161925-02, BRD-K62577500-001-03-6, [(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl] acetate, Furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one, 9-(acetyloxy)-5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, (5R-(5alpha,5abeta,8aalpha,9alpha))- (9CI), Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one,9-(acetyloxy)-5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, (5R,5aR,8aR,9R)-, Furo[3',7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 9-(acetyloxy)-5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, [5R-(5.alpha.,5a.beta.,8a.alpha.,9.alpha.)]-


ID: 2056

chemical graph of compound 2056



InChIKey: SASVNKPCTLROPQ-RGXPITOMSA-N
SMILES: CC(=O)O[C@@H]1[C@H]2COC(=O)[C@H]2[C@@H](C3=CC4=C(C=C13)OCO4)C5=CC(=C(C(=C5)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 233299
synonyms found at PubChem are:
PICROPODOPHYLLOTOXIN ACETATE, 38491-90-6, SR-05000002684, Spectrum_001662, Picropodophyllin, acetate, AC1L5PQN, Spectrum2_000807, Spectrum3_000662, Spectrum4_001634, Spectrum5_000447, BSPBio_002323, KBioGR_002067, KBioSS_002142, (5r,5ar,8as,9r)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl acetate, SPECTRUM1504411, SPBio_000673, CHEMBL454333, SCHEMBL4276054, CTK4I0063, KBio2_002142, KBio2_004710, KBio2_007278, KBio3_001543, NSC31708, NSC-31708, CCG-214618, SDCCGMLS-0066752.P001, NCGC00161924-01, NCGC00161924-02, SR-05000002684-1, SR-05000002684-2, BRD-K99108905-001-02-0, [(5R,5aR,8aS,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl] acetate


ID: 2057

chemical graph of compound 2057



InChIKey: SAVSLMGBKQKUAV-JYJNAYRXSA-N
SMILES: CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)C(F)(F)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 40785040
synonyms found at PubChem are:
Tfa-VAL-TYR-VAL-OH, 64577-63-5, CHEMBL3138715, ZINC8681552, FT-0640958, C-44077, L-Valine,N-(2,2,2-trifluoroacetyl)-L-valyl-L-tyrosyl-, (S)-2-((S)-3-(4-hydroxyphenyl)-2-((S)-3-methyl-2-(2,2,2-trifluoroacetamido)butanamido)propanamido)-3-methylbutanoic acid


ID: 2058

chemical graph of compound 2058



InChIKey: SBHXYTNGIZCORC-ZDUSSCGKSA-N
SMILES: C1[C@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC(=C(C=C3)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 440735
synonyms found at PubChem are:
ERIODICTYOL, 552-58-9, Eriodictiol, (S)-Eriodictyol, UNII-Q520486B8Y, (S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychroman-4-one, (S)-2-(3,4-Dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-4-benzopyrone, CHEMBL8996, CHEBI:28412, Q520486B8Y, (2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one, Q-100627, 3',4',5,7-Tetrahydroxyflavanone, 4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-, (2S)-, eriodicryol, eryodictiol, (+)-Eriodictyol, EINECS 209-016-4, NSC 649412, Eriodictyol with HPLC, D08AIJ, AC1L99UV, SCHEMBL19180, BIDF1031, BIDF1032, Eriodictyol, analytical standard, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-4-one, ZINC58117, MolPort-003-938-846, SBHXYTNGIZCORC-ZDUSSCGKSA-N, 3' 4' 5 7-tetrahydroxyflavanone, 4049-38-1, 5,7,3'',4''-tetrahydroxyflavon, BCP13401, Eriodictyol, >=95.0% (HPLC), BDBM50325671, LMPK12140002, 5,7,3'',4''-tetrahydroxyflavanone, AKOS025311577, Eriodictyol solution, 20 mM in DMSO, AC-6043, API0002587, SC-88664, ZB002321, LS-193891, FT-0686607, N2309, C05631, 552E589, UNII-CQT975GLYF component SBHXYTNGIZCORC-ZDUSSCGKSA-N, (S)-2-(3,4-Dihydroxy-phenyl)-5,7-dihydroxy-chroman-4-one, (2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one, (S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one, (S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychroman-4-one solution, 20 mM in DMSO, (S)-3 inverted exclamation marka,4 inverted exclamation marka,5,7-Tetrahydroxyflavanone, ERD


ID: 2059

chemical graph of compound 2059



InChIKey: SBNFWQZLDJGRLK-UHFFFAOYSA-N
SMILES: CC(=CC1C(C1(C)C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 4767
synonyms found at PubChem are:
phenothrin, Sumithrin, 26002-80-2, Phenoxythrin, Phenothrine, Pibutin, Sumitrin, Duet, Anchimanaito 20S, Wellcide, Solo (insecticide), Multicide 2154, Fenotrina, S 2539 (pesticide), Fenotrina [Spanish], Phenothrine [French], Phenothrinum [Latin], 3-Phenoxybenzyl chrysanthemate, Caswell No. 652B, Phenothrin [INN:BAN], Phenothrine [ISO-French], OMS 1809, OMS 1810, PT 515, CCRIS 2502, Multicide Concentrate F-2271, HSDB 3922, Phenothrin [BSI:ISO], Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (3-phenoxyphenyl)methyl ester, EINECS 247-404-5, S-2539, ENT 27 972, EPA Pesticide Chemical Code 069005, delta-(cis-trans)-Phenothrin, 3-phenoxybenzyl 2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate, 2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylic acid (3-phenoxyphenyl)methyl ester, AI3-29062, D-Phenothrin, 188023-86-1, CHEBI:34916, 3-Phenoxybenzyl (+-)-cis-trans-chrysanthemate, 3-Phenoxybenzyl (1RS)-cis,trans-chrysanthemate, SBNFWQZLDJGRLK-UHFFFAOYSA-N, m-Phenoxybenzyl 2,2-dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylate, 2,2-Dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylic acid m-phenoxybenzyl ester, 3-Phenoxybenzyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate, S-2539F, NCGC00094561-01, 3-Phenoxybenzyl 2-dimethyl-3-(methylpropenyl)cyclopropanecarboxylate, (3-Phenoxyphenyl)methyl 2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylate, (3-phenoxyphenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate, 3-Phenoxybenzyl (1RS)-cis,trans-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate, 3-Phenoxybenzyl (1RS,3RS;1RS,3SR)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate, Benzyl alcohol, m-phenoxy-, 2,2-dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylate, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, m-phenoxybenzyl ester, DSSTox_CID_12688, DSSTox_RID_79033, DSSTox_GSID_32688, Phenothrinum, m-Phenoxybenzyl (+-)-cis,trans-2,2-dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylate, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 3-(phenoxyphenyl)methyl ester, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 3-(phenoxyphenyl)methyl ester, cis,trans-(+/-)-, CAS-26002-80-2, Phonothrin, (R)-Phenothrin, Phenothrin (INN), Hegor antipoux (TN), Spectrum_001981, SpecPlus_000796, AC1L1IWQ, Spectrum3_001204, Spectrum4_000583, Spectrum5_000644, SCHEMBL74649, BSPBio_002588, KBioGR_001046, KBioSS_002547, MLS004712075, DivK1c_006892, SPECTRUM1504098, CHEMBL1322884, DTXSID7032688, CTK8G3999, KBio1_001836, KBio2_002538, KBio2_005106, KBio2_007674, KBio3_002088, MolPort-003-930-931, s538, HMS1922B17, Pharmakon1600-01504098, HY-B1072, Tox21_111297, Tox21_301570, CCG-38960, NSC758668, Phenothrin 10 microg/mL in Isooctane, AKOS015914551, Tox21_111297_1, CS-4628, NSC-758668, ACM26002802, NCGC00094561-02, NCGC00094561-03, NCGC00094561-04, NCGC00094561-06, NCGC00255299-01, ACM188023861, AK129237, BC680104, LS-58710, SC-16053, SC-19633, SMR001563205, SBI-0051922.P002, AX8019762, KB-236765, 542-EP2274983A1, 542-EP2280009A1, 542-EP2308857A1, 542-EP2314583A1, FT-0630520, Phenothrin, PESTANAL(R), analytical standard, C14387, D08357, S 2539, AB00052445_02, AB00052445_03, 002P802, A818137, SR-01000872757, J-016219, SR-01000872757-1, BRD-A22106989-001-01-9, BRD-A22106989-001-02-7, I14-41370, (3-phenoxyphenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate, 2,2-Dimethyl-3-(2-methylpropenyl-1)cyclopropancarbonic acid, 3-phenoxybenzyl ester, 3-Phenoxybenzyl 2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylate #, 3-phenoxyphenylmethyl 2,2-dimethyl- 3-(2-methyl-1-propenyl)cyclopropanecarboxylate, Cyclopropanecarboxylic acid,2,2-dimethyl-3-(2-methylpropen-1-yl), 3-phenoxybenzyl ester, 2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylic acid (3-phenoxy-phenyl)methyl ester, 2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid (3-phenoxyphenyl)methyl ester, 53528-32-8, 73170-79-3


ID: 2060

chemical graph of compound 2060



InChIKey: SBPBAQFWLVIOKP-UHFFFAOYSA-N
SMILES: CCOP(=S)(OCC)OC1=NC(=C(C=C1Cl)Cl)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2730
synonyms found at PubChem are:
chlorpyrifos, 2921-88-2, Chlorpyriphos, Dursban, Trichlorpyrphos, Lorsban, Chlorpyrifos-ethyl, Brodan, Coroban, Pyrinex, Killmaster, Bonidel, Danusban, Geodinfos, Lentrek, Piridane, Spannit, Stipend, Tafaban, Durmet, Equity, Terial, Zidil, Suscon blue, Suscon green, suSCon, Dursban F, Dursban R, Lock-On, Dursban 4E, Chlorpyriphos-ethyl, Dowco 179, Ethyl chlorpyriphos, Clorpyrifos, Dursban 10CR, Chlorpyrifos (Dursban), Detmol U.A., Chloropyrifos, Phosphorothioic acid, O,O-diethyl O-(3,5,6-trichloro-2-pyridinyl) ester, Dhanusban, Grofo, Detmol ua, Chlorpyrifos ethyl, Radar (fungicide), Dursban 44, Lorsban 50SL, Empire 20, Terial 40L, Chlorpyrifos [BAN], Chloropyriphos, Chlorpyrofos, Chlorpyrophos, Pageant, Silrifos, Caswell No. 219AA, m-Chlorpyrifos, XRM 429, O,O-Diethyl O-3,5,6-trichloro-2-pyridyl phosphorothioate, C9H11Cl3NO3PS, OMS-0971, XRM 5160, Dursban 2E, Chlorpyriphos [ISO-French], UNII-JCS58I644W, ENT 27311, CCRIS 7144, HSDB 389, Chlorpyrifos [ANSI:BSI:ISO], EINECS 220-864-4, O,O-Diethyl O-(3,5,6-trichloro-2-pyridinyl)phosphorothioate, EPA Pesticide Chemical Code 059101, BRN 1545756, Phosphorothioic acid, O,O-diethyl O-(3,5,6-trichloro-2-pyridyl) ester, AI3-27311, MLS001065609, JCS58I644W, O,O-Diaethyl-O-3,5,6-trichlor-2-pyridylmonothiophosphat, O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate, CHEBI:34631, SBPBAQFWLVIOKP-UHFFFAOYSA-N, 2-Pyridinol, 3,5,6-trichloro-, O-ester with O,O-diethyl phosphorothioate, Chlorpyrifos (BAN), O,O-Diethyl O-(3,5,6-trichloro-2-pyridyl) phsophorothioate, SMR000568474, DSSTox_CID_458, O,O-Diaethyl-O-3,5,6-trichlor-2-pyridylmonothiophosphat [German], DSSTox_RID_75603, DSSTox_GSID_20458, o,o-Diethyl-o-(3,5,6-trichloro-2-pyridyl)phosphorothioate, O,O-Diethyl O-(3,5,6-Trichloro-2-pyridyl) phosphorothioate, O,O-Diethyl-O-(3,5,6-trichloro-2-pyridyl)phosphorothiolate, O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) phosphorothioate, diethoxy-sulfanylidene-(3,5,6-trichloropyridin-2-yl)oxyphosphorane, diethoxy-sulfanylidene-[(3,5,6-trichloro-2-pyridinyl)oxy]phosphorane, CAS-2921-88-2, pridane, Chlorpyritos, Affront, Paqeann, Piridann, Empirn, Eraden, Scoun, Detmol Un, diethoxy-sulfanylidene-(3,5,6-trichloropyridin-2-yl)oxy-?^{5}-phosphane, detmol u. a, Detmol U.A, Chlorpyrifos solution, Stipend and Tricel., Zodiac (TN), Chloropyrifos solution, Dowco 179, Dursban, Spectrum_001897, SpecPlus_000518, Spectrum2_001230, Spectrum3_000849, Spectrum4_000689, Spectrum5_002014, C7H7Cl3NO3PS, D0M5ES, AC1L1EC5, cid_2730, Dursban, analytical standard, BIDD:PXR0044, SCHEMBL21680, BSPBio_002437, KBioGR_001157, KBioSS_002427, SPECTRUM330058, DivK1c_006614, SPBio_001080, AC1Q38B6, CHEMBL463210, DTXSID4020458, BDBM74063, CTK8E8187, KBio1_001558, KBio2_002421, KBio2_004989, KBio2_007557, KBio3_001937, SBPBAQFWLVIOKP-UHFFFAOYSA-, OMS 971, MolPort-003-665-453, HMS3039C03, HMS3264O03, Pharmakon1600-00330058, ZINC608250, Tox21_202383, Tox21_300148, AC-993, CCG-39144, ENT-27311, NSC755891, AKOS015891656, Phosphorothioic acid O,O-diethyl O-(3,5,6-trichloro-2-pyridinyl) ester, ENT 27,311, KS-5372, LS-1137, NSC-755891, NCGC00091472-01, NCGC00091472-02, NCGC00091472-03, NCGC00091472-04, NCGC00091472-05, NCGC00091472-06, NCGC00091472-07, NCGC00091472-08, NCGC00091472-09, NCGC00253974-01, NCGC00259932-01, AN-15356, BC220240, CC-25729, Chlorpyrifos 10 microg/mL in Cyclohexane, O799, SC-47023, ZB014607, Chlorpyrifos 10 microg/mL in Acetonitrile, Chlorpyrifos 100 microg/mL in Cyclohexane, SBI-0052543.P002, Chlorpyrifos 100 microg/mL in Acetonitrile, TR-036379, FT-0602970, C14322, D07688, M-1133, 26848-EP2274983A1, 26848-EP2275422A1, 26848-EP2280002A1, 26848-EP2280009A1, 26848-EP2292608A1, 26848-EP2305662A1, 26848-EP2308857A1, 26848-EP2308858A1, 26848-EP2311816A1, 26848-EP2311817A1, 26848-EP2314583A1, 88579-EP2298076A1, 88579-EP2298077A1, 88579-EP2301353A1, 88579-EP2305031A1, 88579-EP2305034A1, 88579-EP2305035A1, 88579-EP2305662A1, AB00053051_06, Chlorpyrifos, PESTANAL(R), analytical standard, 921C882, A819822, C-20634, SR-01000854727, I02-0698, I06-1337, J-017440, SR-01000854727-2, BRD-K08303368-001-02-7, BRD-K08303368-001-06-8, Chlorpyrifos Solution, 100 mg/L, (RM, ISO Guide 34), Chlorpyrifos, certified reference material, TraceCERT(R), Diethyl O-(3,5,6-trichloro-2-pyridyl) phosphorothioate, O,O-Diethyl O-3,5,6-trichloro-2-pyridylphosphorothioate, O,O- diethyl-O-(3,5,6-trichloro-2-pyridyl)thiophosphate, diethoxy-thioxo-[(3,5,6-trichloro-2-pyridyl)oxy]phosphorane, O,O-Diethyl o-(3,5,6-trichloro-2-pyridinyl) thiophosphate #, diethoxy-sulfanylidene-(3,5,6-trichloropyridin-2-yl)oxy--phosphane, diethoxy-thioxo-[(3,5,6-trichloro-2-pyridyl)oxy]-$l^{5}-phosphane, ethyl 3,5,6-trichloropyridin-2-yl ethoxy(sulfanylidene)phosphonite, O,O-diethyl O-(3,5,6-trichloro-2-pyridinyl) phosphorothioic acid, O,O-DIETHYL O-3,5,6-TRICHLOROPYRIDIN-2-YL PHOSPHOROTHIOATE, diethoxy-sulfanylidene-[3,5,6-tris(chloranyl)pyridin-2-yl]oxy--phosphane, Phosphorothioic Acid O,O-Diethyl O-(3,5,6-Trichloro-2-pyridinyl)ester, Chlorpyrifos solution, 100 mug/mL in acetonitrile, PESTANAL(R), analytical standard, diethoxy-sulfanylidene-[3,5,6-tris(chloranyl)pyridin-2-yl]oxy-$l^{5}-phosphane, 12768-48-8, 39475-55-3, Chlorpyrifos solution, certified reference material, TraceCERT(R), 1000 mug/mL in methyl tert-butyl ether, ampule of 1 mL, InChI=1/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3


ID: 2061

chemical graph of compound 2061



InChIKey: SCKYRAXSEDYPSA-UHFFFAOYSA-N
SMILES: CC1=CC(=O)N(C(=C1)C2CCCCC2)O

biological descriptors:

CFTR relevance: CFTR proteostasis regulator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction indirect
subcellular compartment several

reference list:

"N Pedemonte" "AI Esposito" "V Tomati" "E Caci" "LJ Galietta" "U Pfeffer" "E Sondo"


CID is 2749
synonyms found at PubChem are:
CICLOPIROX, 29342-05-0, Loprox, Penlac, Ciclopiroxum, Batrafen, HOE 296b, Stieprox, Terit, Ciclopiroxum [INN-Latin], cyclopirox, Mycoster, Ciclopirox gel, cyclopyroxolamine, Loprox cream, HOE-296b, Loprox Gel, Ciclopirox Olamin, Ciclopirox-Olamin, Dafnegin-CSC, 6-Cyclohexyl-1-hydroxy-4-methyl-2(1H)-pyridone, 2(1H)-Pyridinone, 6-cyclohexyl-1-hydroxy-4-methyl-, 6-cyclohexyl-1-hydroxy-4-methylpyridin-2(1H)-one, Loprox Shampoo, 6-Cyclohexyl-1-hydroxy-4-methyl-2(1H)-pyridinone, UNII-19W019ZDRJ, Penlac nail lacquer, Ciclopirox [USAN:BAN:INN], Loprox (TN), Penlac (TN), Ciclopirox (Penlac), Ciclopirox (USP/INN), EINECS 249-577-2, HOE-296, 19W019ZDRJ, 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one, C12H17NO2, CHEBI:453011, SCKYRAXSEDYPSA-UHFFFAOYSA-N, 2(1H)-Pyridone, 6-cyclohexyl-1-hydroxy-4-methyl-, 6-CYCLOHEXYL-1-HYDROXY-4-METHYL-1H-PYRIDIN-2-ONE, 6-cyclohexyl-1-hydroxy-4-methyl-pyridin-2-one, 6-Cyclohexyl-1-hydroxy-4-methyl-2-(1H)-pyridone, (6-Cyclohexyl-1-hydroxy-4-methyl-2(1H)-pyridone), W-106995, MLS002153867, CNL8, SMR001233223, Ciclopirox [USAN:USP:INN:BAN], Batrafen (TN), Stieprox (TN), 2-aminoethanol;6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one, AC1L1EDN, Prestwick0_000541, Prestwick1_000541, Prestwick2_000541, Prestwick3_000541, Spectrum2_000146, Spectrum3_000351, Spectrum4_000288, Spectrum5_000747, D07GRH, CHEMBL1413, SCHEMBL34424, BSPBio_000581, BSPBio_002041, KBioGR_000816, cid_38911, KSC563C4H, BIDD:GT0080, SPBio_000252, SPBio_002502, BPBio1_000641, ZINC1145, DTXSID9048564, BDBM66087, CTK4G3143, KBio3_001261, MolPort-003-845-943, HMS3656I12, BCP28530, HY-B0450, KS-00000L3N, AN-773, BG0571, s2528, AKOS015895717, AB06517, CS-2561, DB01188, KS-5085, NCGC00017112-04, NCGC00017112-05, NCGC00017112-06, NCGC00017112-08, NCGC00017112-11, NCGC00178850-01, NCGC00178850-02, AC-24195, AJ-07970, AK544043, BC205517, CC-25776, SC-17361, SBI-0206690.P002, AB0011605, AB2000628, KB-270156, LS-174247, TL8002303, 1-hydroxy-4-methyl-6-cyclohexyl-2-pyridone, FT-0602961, 6-cyclohexyl-1-hydroxy-4-methyl-2-pyridinone, D03488, 6-cyclohexyl-4-methyl-1-oxidanyl-pyridin-2-one, AB00053438_09, AB00053438_10, AB00053438_11, 342C050, A819878, C-10474, 6-Cyclohexenyl-1-hydroxy-4-methyl-2(1h)-pyridone, 6-cyclohexyl-1-hydroxy-4-methyl-2(1 H)-pyridinone, Batrafen; Loprox;Mycoster;Stieprox;HOE 296b;Penlac, I06-0862, SR-05000001589-5, 6-cyclohexyl-1-hydroxy-4-methyl-2(1 H )-pyridinone, 6-Cyclohexyl-1-hydroxy-4-methyl-2(1H)-pyridinone #, BRD-K13044802-213-04-1, BRD-K13044802-213-09-0, 2-aminoethanol;6-cyclohexyl-1-hydroxy-4-methyl-2-pyridone, 6-cyclohexyl-1-hydroxy-4-methyl-1,2-dihydropyridin-2-one, 2-aminoethanol;6-cyclohexyl-1-hydroxy-4-methyl-2-pyridinone, 2-azanylethanol;6-cyclohexyl-4-methyl-1-oxidanyl-pyridin-2-one


ID: 2062

chemical graph of compound 2062



InChIKey: SCLZRKVZRBKZCR-SLINCCQESA-M
SMILES: CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)[O-].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 12557
synonyms found at PubChem are:
Cloxacillin sodium, Cloxacillin sodium salt, 642-78-4, Sodium cloxacillin, Cloxacillin sodium anhydrous, Sodium orbenin, Monosodium cloxacillin, Sodium syntarpen, Austrastaph, Staphybiotic, Ankerbin, Ekvacillin, Gelstaph, Orbenin sodium, Prevencilina P, Prostaphilin A, Prostaphlin A, BRL 1621 sodium salt, Tegopen, Syntarpen sodium salt, UNII-MWQ645MKMF, BRL-1621 sodium salt, EINECS 211-390-9, MWQ645MKMF, 3-o-Chlorophenyl-5-methyl-4-isoxazolylpenicillin sodium, Sodium 3-(o-chlorophenyl)-5-methyl-4-isoxazolylpenicillin, CHEBI:51357, DSSTox_CID_25551, DSSTox_RID_80950, DSSTox_GSID_45551, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamido)-3,3-dimethyl-7-oxo-, monosodium salt, (2S,5R,6R)-, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamido)-3,3-dimethyl-7-oxo-, monosodium salt, (2S-(2alpha,5alpha,6beta))-, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(3-(o-chlorophenyl)-5-methyl-4-isoxazolecarboxamido)-3,3-dimethyl-7-oxo-, monosodium salt, Cloxacillin sodium salt monohydrate, NCGC00017029-01, CAS-642-78-4, Prestwick_916, sodium cloxacillin(1-), 5-Methyl-3-(o-chlorophenyl)-4-isoxazolyl] pencillin, C19H17ClN3NaO5S, C19H17ClN3O5S.Na, SCHEMBL41013, MLS002154231, 61-72-3 (free acid), SPECTRUM1500201, Cloxacillin Sodium (anhydrous), CHEMBL262636, DTXSID4045551, CTK8F8746, HMS502E18, MolPort-002-509-865, HMS1568F13, HMS1920A04, HMS2091G12, HMS2095F13, HMS2234C11, HMS3712F13, BCP10752, Tox21_110744, CCG-40259, MFCD00063568, AKOS027250800, Tox21_110744_1, API0002088, MCULE-7556215634, NCGC00178840-05, AN-20457, SMR000718745, LS-149770, Cloxacillin sodium salt, >=97.0% (HPLC), FT-0603191, 7081-44-9 (.H2O), 1252-37-5, 50794-85-9, sodium (2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium (2S,5R,6R)-6-[[3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium 2,2-dimethyl-6beta-({[5-methyl-3-(2-chlorophenyl)isoxazol-4-yl]carbonyl}amino)penam-3alpha-carboxylate


ID: 2063

chemical graph of compound 2063



InChIKey: SCMSYZJDIQPSDI-SRVKXCTJSA-N
SMILES: CC(C)CCNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1[C@H](O1)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 123664
synonyms found at PubChem are:
76684-89-4, e-64c, Loxistatin acid, EP 475, EP 475 (Enzyme inhibitor), E 64c, MLS000028693, E-64-c, C15H26N2O5, BRN 6688621, Loxistatin Acid (E-64C), SMR000058872, CHEMBL418661, E-64c;EP 475, N-(N-(3-carboxyoxirane-2-carbonyl)leucyl)isoamylamine, NSC 694279, L-trans-Epoxysuccinyl-Leu-3-methylbutylamide, (+)-(2S,3S)-3-((S)-3-Methyl-1-(3-methylbutylcarbamoyl)butylcarbamoyl)-2-oxiranecarboxylic acid, (2S,3S)-3-[[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylic acid, (2S,3S)-3-{[(1S)-3-methyl-1-[(3-methylbutyl)carbamoyl]butyl]carbamoyl}oxirane-2-carboxylic acid, Oxiranecarboxylic acid, 3-(((3-methyl-1-(((3-methylbutyl)amino)carbonyl)butyl)amino)carbonyl)-, (2S-(2-alpha,3-beta(R*)))-, Oxiranecarboxylic acid, 3-(((3-methyl-1-(((3-methylbutyl)amino)carbonyl)butyl)amino)carbonyl)-, (2S-(2alpha,3beta(R*)))-, SR-01000000286, (2S,3S)-trans-Epoxysuccinyl-L-leucylamido-3-methylbutane, Opera_ID_1991, Ec64-c, E-64c Calpain Inhibitor, AC1L3X2J, AC1Q5JQ7, E-64c, Calpain Inhibitor, [2S,3S]-trans-Epoxysuccinyl-L-leucylamido-3-methylbutane, (2s,3s)-3-({(2s)-4-methyl-1-[(3-methylbutyl)amino]-1-oxopentan-2-yl}carbamoyl)oxirane-2-carboxylic acid, epoxysuccinyl derivative E64c, cid_123664, E64C, SCHEMBL3281530, BDBM16510, E 64-c, MolPort-003-941-226, SCMSYZJDIQPSDI-SRVKXCTJSA-N, ZINC3913936, 2390AH, MFCD00132882, s7392, AKOS027250809, CCG-207845, CCG-208199, HO-tES-Leu-NH-CH2-CH2CH(CH3)2, NCGC00023595-03, LS-101007, 684E894, SR-01000000286-2, SR-01000000286-3, BRD-K21937671-001-10-0, N-(N-(L-3-trans-carboxyoxirane -2-carbonyl)-L-leucyl)isoamylamine, N-(N-(3-transcarboxyoxirane-2-carbonyl)-L-leucyl)-3-methylbutylamine, (2S,3S)-3-[[(1S)-1-(isoamylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylic acid, (2R,3S)-3-((S)-1-(isopentylamino)-4-methyl-1-oxopentan-2-ylcarbamoyl)oxirane-2-carboxylic acid, (2S,3S)-3-[[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxidanylidene-pentan-2-yl]carbamoyl]oxirane-2-carboxylic acid, (2S,3S)-3-[[[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxopentan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid


ID: 2064

chemical graph of compound 2064



InChIKey: SCULJPGYOQQXTK-OLRINKBESA-N
SMILES: CC(=O)O[C@@H]1[C@@H]([C@]2(CC[C@H]3[C@H]([C@@]24[C@@H]1O4)CC[C@H]5[C@@]3(CC[C@@H](C5)O)C)C)C6=COC(=O)C=C6

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 11969542
synonyms found at PubChem are:
Cinobufagin, 470-37-1, Cinobufagine, Cino-bufagin, UNII-T9PSN4R8IR, T9PSN4R8IR, CHEBI:80805, NSC90325, SCHEMBL642990, CHEMBL250785, MolPort-003-940-630, HY-N0421, ZINC4215351, 8074AH, MFCD00056825, NSC-90325, CCG-208337, CS-3697, SC-76202, C3460, N1154, ST24044142, C16931, 470C371, SR-05000002305, Q-100496, SR-05000002305-2, 14,15|A-Epoxy-3|A,16|A-dihydroxy-5|A,20(22)-bufadienolide 16-acetate, 5|A,20(22)-Bufadienolide-3|A,16|A-diol-14,15|A-epoxy 16-acetate, 14,15beta-Epoxy-3beta,16beta-dihydroxy-5beta,20(22)-bufadienolide 16-acetate, 5.beta.-Bufa-20, 14,15.beta.-epoxy-3.beta.,16.beta.-dihydroxy-, 16-acetate, 5beta-Bufa-20,22-dienolide, 14,15beta-epoxy-3beta,16beta-dihydroxy-, 16-acetate (8CI), Bufa-20, 16-(acetyloxy)-14,15-epoxy-3-hydroxy-, (3.beta.,5.beta.,15.beta.,16.beta.)-, 14,15beta-Epoxy-3beta,16beta-dihydroxy-5beta,20(22)-bufadienolide 16-acetate, 5beta,20(22)-Bufadienolide-3beta,16beta-diol-14,15beta-epoxy 16-acetate, 5-((1R,2R,2aR,3aS,3bR,5aR,7S,9aS,9bS,11aR)-2-Acetyl-7-hydroxy-9a,11a-dimethylhexadecahydronaphtho[1',2'


ID: 2065

chemical graph of compound 2065



InChIKey: SCVHFRLUNIOSGI-UHFFFAOYSA-N
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CCCC3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 1917
synonyms found at PubChem are:
8-Cyclopentyl-1,3-dimethylxanthine, 8-cyclopentyltheophylline, 35873-49-5, 8-Cyclopentyl theophylline, 1,3-dimethyl-8-cyclopentylxanthine, UNII-U7PWT4CPL5, U7PWT4CPL5, 8-cyclopentyl-1,3-dimethyl-7H-purine-2,6-dione, NSC 101806, BRN 1133199, Xanthine, 8-cyclopentyl-1,3-dimethyl-, Theophylline, 8-cyclopentyl-, CHEMBL106265, 8-Cyclopentyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 1H-Purine-2,6-dione, 8-cyclopentyl-3,9-dihydro-1,3-dimethyl-, Spectrum_000351, Lopac-C-102, AC1L1CIO, AC1Q6LAU, Spectrum2_001734, Spectrum3_000658, Spectrum4_000760, Spectrum5_001769, D0L5JL, NCIOpen2_006919, Lopac0_000391, BSPBio_002295, GTPL385, KBioGR_001120, KBioSS_000831, MLS000859932, DivK1c_000824, SCHEMBL431907, SPECTRUM2300193, SPBio_001808, CPT; 8-Cyclopentyltheophylline, 8-cyclopentyltheophylline (cpt), SCHEMBL18029489, BDBM81925, CTK4H5503, HMS502J06, KBio1_000824, KBio2_000831, KBio2_003399, KBio2_005967, KBio3_001515, DTXSID70189432, CHEBI:109538, MolPort-003-846-098, NINDS_000824, SCVHFRLUNIOSGI-UHFFFAOYSA-N, HMS2231K17, HMS3261O03, HMS3374O03, 1H-Purine-2,6-dione, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl-, CAS_1917, NSC_1917, Tox21_500391, CCG-39502, NSC101806, PDSP1_000994, PDSP2_000978, ZINC15880093, AKOS027320620, AKOS030211020, CCG-221695, LP00391, NSC-101806, IDI1_000824, Mol Pharmacol 29: 331 (1986), NCGC00015178-01, NCGC00015178-02, NCGC00015178-03, NCGC00015178-04, NCGC00015178-05, NCGC00015178-06, NCGC00015178-07, NCGC00093819-01, NCGC00093819-02, NCGC00093819-03, NCGC00093819-04, NCGC00261076-01, SMR000326793, DB-048886, LS-149466, C-102, EU-0100391, FT-0639285, 8-cyclopentyl-1,3-dimethyl-9H-purine-2,6-dione, L000085, SR-01000075232, SR-01000075232-1, BRD-K38347298-001-02-3, BRD-K38347298-001-06-4, 1H-Purine-2, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl-, 8-Cyclopentyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione, 1H-Purine-2,6-dione,8-cyclopentyl-3,9-dihydro-1,3-dimethyl-, 8-Cyclopentyl-1,3-dimethylxanthine, >=98% (HPLC), powder, 1H-Purine-2,6-dione, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl- (9CI), 8-cyclopentyl-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione


ID: 2066

chemical graph of compound 2066



InChIKey: SCZVLDHREVKTSH-UHFFFAOYSA-N
SMILES: COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5280666
synonyms found at PubChem are:
Chrysoeriol, 491-71-4, Chryseriol, 3'-Methoxyapigenin, Luteolin 3'-methyl ether, 3'-O-Methylluteolin, 3'-O-Methyluteolin, 4',5,7-trihydroxy-3'-methoxyflavone, 5,7,4'-Trihydroxy-3'-methoxyflavone, 5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-benzopyrone, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-, UNII-Q813145M20, EINECS 207-742-6, 5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one, BRN 0295004, CHEMBL214321, CHEBI:16514, 3'-Methoxy-4',5,7-trihydroxyflavone, Q813145M20, FLAVONE, 4',5,7-TRIHYDROXY-3'-METHOXY-, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one, Chrysoeril, Chrysoriol, Scoparol, CCRIS 9338, 3''-Methoxyapigenin, AC1NQXE5, D01FGM, Luteolin 3''-methyl ether, MLS001048958, SCHEMBL293757, cid_5280666, DTXSID60197687, MolPort-002-511-856, SCZVLDHREVKTSH-UHFFFAOYSA-N, HMS2271C08, ZINC519621, BCP28924, BDBM50241084, LMPK12110799, NSC732318, AKOS004110683, MCULE-7873890076, NSC-732318, 4',5,7-Trihydroxy-3'-methoxy-Flavone, NCGC00163527-01, 4'',5,7-trihydroxy-3''-methoxyflavone, 4CN-2225, KB-41367, LS-69048, SMR000386981, ST077089, ZB014281, 2-(5-methoxy,7-dihydroxy-benzpyran-4-one, FT-0665034, W1640, 3'-METHOXY-5,7,4'-TRIHYDROXYFLAVONE, C04293, C-57505, SR-01000758948, SR-01000758948-3, 2-(5-methoxy,4-hydroxyphenyl)5,7-dihydroxy-benzpyran-4-one, 5-7-Dihydroxy-2--4-hydroxy-3-methoxyphenyl--4H-1-benzopyran-4-one, 5,7-DIHYDROXY-2-(4-HYDROXY-3-METHOXY-PHENYL)-CHROMEN-4-ONE, 5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one, 9CI


ID: 2067

chemical graph of compound 2067



InChIKey: SEBFKMXJBCUCAI-HKTJVKLFSA-N
SMILES: COC1=C(C=CC(=C1)[C@@H]2[C@H](OC3=C(O2)C=C(C=C3)[C@@H]4[C@H](C(=O)C5=C(C=C(C=C5O4)O)O)O)CO)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 31553
synonyms found at PubChem are:
silibinin, Silybin, 22888-70-6, SILYMARIN, Flavobin, Silymarin I, Silybin A, Silibinine, Silliver, Silybine, Silibinin A, Silibininum, Silibinina, Flavobin Spofa, Silymarine I, Silibinin [INN], Silymarine, Silibinine [INN-French], Silibininum [INN-Latin], Silibinina [INN-Spanish], 7C3MT, Legalon, UNII-33X338MNE4, EINECS 245-302-5, NSC 651520, Silibin, Silimarin, CHEBI:9144, 33X338MNE4, Silibinin (INN), C25H22O10, NSC651520, NCGC00091057-01, DSSTox_CID_6018, DSSTox_RID_77985, DSSTox_GSID_26018, (2R,3R)-3,5,7-trihydroxy-2-((2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydrobenzo[b][1,4]dioxin-6-yl)chroman-4-one, 36804-17-8, silybinin, Silibinin (mixture of A/B isomers), Silybin (7CI), (2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxy-phenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]chroman-4-one, (2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-chromen-4-one, (2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydrochromen-4-one, 3,5,7-Trihydroxy-2-(3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxan-6-yl)-4-chromanone, 4H-1-Benzopyran-4-one, 2,3-dihydro-2-(2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl)-3,5,7-trihydroxy-, (2R-(2-alpha,3-beta,6(2R*,3R*)))-, 4H-1-Benzopyran-4-one, 2-(2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl)-2,3-dihydro-3,5,7-trihydroxy-, (2R-(2alpha,3beta,6(2R*,3R*)))-, CAS-22888-70-6, dura-silymarin, CCRIS 9378, Legalon (TN), Silibinin (Silybin), Silybin, Technical grade, AC1L1LUB, AC1Q6OSA, Spectrum2_001694, Spectrum3_001132, Spectrum4_001978, Spectrum5_001893, BSPBio_002623, KBioGR_002481, MLS001304057, SCHEMBL324884, SPECTRUM1505256, SPBio_001648, CHEMBL431701, MEGxp0_001301, DTXSID8026018, KBio3_002123, KS-00000KGH, MolPort-001-741-606, SEBFKMXJBCUCAI-HKTJVKLFSA-N, HMS1922P05, HMS2232P03, 2,3-Dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-6-(3,5,7-trihydroxy-4-oxobenzopyran-2-yl)benzodioxin, 2-[2R,3R-Dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl]-2R,3R-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one, 802918-57-6, ZINC2033589, Tox21_111070, Tox21_200755, AN-924, BDBM50084982, CCG-38779, MFCD03225424, s2357, Silibinin solution, 20 mM in DMSO, Silybin, mixture of isomers A and B, AKOS004119918, Tox21_111070_1, API0026191, CS-2128, DB09298, DS-9661, LS-2125, MCULE-6463439345, MCULE-8379030042, NSC-651520, SDCCGMLS-0066916.P001, SMP2_000323, NCGC00091057-02, NCGC00091057-03, NCGC00091057-05, NCGC00258309-01, Silybin A (constituent of milk thistle), BP-30210, HY-13748, R765, SMR000718776, SBI-0207018.P001, Silibinin, disposable screening library format, 88S706, D08515, W-2484, AB00876265_06, SR-01000799140, Q-100291, SR-01000799140-2, BRD-K80353138-001-02-2, BRD-K80353138-001-07-1, Silibinin [mixture of A (2R,3R) and B (2R,3R) isomers], UNII-4RKY41TBTF component SEBFKMXJBCUCAI-HKTJVKLFSA-N, Silibinin (mixture of A/B isomers) solution, 20 mM in DMSO, (2R,3R)-3,5,7-trihydroxy-2-((2,3-anti)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydrobenzo[b][1,4]dioxin-6-yl)chroman-4-one, (2R,3R)-3,5,7-Trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxy-phenyl)-2-hydroxymethyl-2,3-dihydro-benzo[1,4]dioxin-6-yl]-chroman-4-one, (2R,3R)-3,5,7-Trihydroxy-2-[3-(4-hydroxy-3-methoxy-phenyl)-2-hydroxymethyl-2,3-dihydro-benzo[1,4]dioxin-6-yl]-chroman-4-one, 11054-49-2, 11076-05-4, 11076-06-5, 142796-20-1, 22888-69-3, 27359-03-1, 28577-40-4, 29832-10-8, 3,5,7-Trihydroxy-2-(3-(4-hydroxy-3-methoxyphenyl)- 2-(hydroxymethyl)-1,4-benzodioxan-6-yl)-4-chromanone, 3,5,7-Trihydroxy-2-[3-(4-hydroxy-3-methoxy-phenyl)-2-hydroxymethyl-2,3-dihydro-benzo[1,4]dioxin-6-yl]-chroman-4-one, 3,5,7-trihydroxy-2-[3-(4-hydroxy-3-methoxyphenyl)-2-hydroxymethyl-(2R,3R)-2,3-dihydrobenzo[b][1,4]dioxin-6-yl]-(2R,3R)-3,4-dihydro-2H-4-chromenone, 37574-50-8, 4H-1-Benzopyran-4-one, 2-[(2R,3R)-2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-, (2R,3R)-, 50976-99-3, 87725-90-4


ID: 2068

chemical graph of compound 2068



InChIKey: SEEPANYCNGTZFQ-UHFFFAOYSA-N
SMILES: C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5215
synonyms found at PubChem are:
sulfadiazine, 68-35-9, Sulphadiazine, Sulfapyrimidine, Sulfadiazin, Sulfazine, Sulfadiazene, Liquadiazine, Sulfapyrimidin, Adiazin, Adiazine, Debenal, Pyrimal, 2-Sulfanilamidopyrimidine, Cremodiazine, Spofadrizine, Theradiazine, Cremotres, Deltazina, Diazolone, Eskadiazine, Microsulfon, Neotrizine, Palatrize, Piridisir, Quadetts, Quadramoid, Sanodiazine, Sterazine, Sulfatryl, Sulfolex, Sulfonsol, Terfonyl, Trifonamide, Truozine, Diazin, Diazyl, Neazine, Pirimal, Sulfose, Trisem, Sulfanilamidopyrimidine, Honey diazine, Lipo-Levazine, Tri-Sulfameth, Triple Sulfas, Coco-Diazine, Lipo-Diazine, Metha-Meridiazine, Sulfadiazinum, Diazovit, Sulfadiazina, Sulphadiazine E, Sulfapirimidin, Di-Azo-Mul, Thi-Di-Mer, 2-Sulfanilylaminopyrimidine, Codiazine, Silvadene, Pecta-diazine, suspension, Benzenesulfonamide, 4-amino-N-2-pyrimidinyl-, Solfadiazina, CocoDiazine, Solfadiazina [DCIT], RP 2616, 4-amino-N-(pyrimidin-2-yl)benzenesulfonamide, Pyrimidine, 2-sulfanilamido-, 2-Sulfanilamidopyrimidin, Sulfapyrimidin [German], Zinc Sulfadiazine, 2-Sulfapyrimidine, Sulfonamides Duplex, Sulfadiazinum [INN-Latin], Sulfadiazina [INN-Spanish], 4-AMINO-N-2-PYRIMIDINYLBENZENESULFONAMIDE, N(1)-2-pyrimidylsulfanilamide, N(1)-2-pyrimidinylsulfanilamide, Pecta-Diazine, 2-Sulfanilamidopyrimidin [German], S.N. 112, 4-amino-N-pyrimidin-2-ylbenzenesulfonamide, A 306, A-306 (VAN), N(sup 1)-2-Pyrimidinylsulfanilamide, Sulfadiazine (TN), Thermazene, N1-2-Pyrimidinylsulfanilamide, Sildaflo, CHEBI:9328, Sulfadiazine [USAN:INN:JAN], Sulfanilamide, N(sup 1)-2-pyrimidinyl-, rBPI21 & Sulfa, N(sup1)-2-Pyrimidylsulfanilamide, Sulfanilamide, N1-2(1H)-pyrimidinylidene-, 4-amino-N-pyrimidin-2-yl-benzenesulfonamide, N1-(Pyrimidin-2-yl)sulfanilamide, Sulfanilamide, N1-2-pyrimidinyl-, UNII-0N7609K889, A-306, N(sup1)-2-Pyrimidinylsulfanilamide, EINECS 200-685-8, NSC 35600, 2-Sulfanilamido-pyrimidine, 4-amino-N-(pyrimidin-2-yl)benzene-1-sulfonamide, CHEMBL439, N1-2-Pyrimidylsulfanilamide, BRN 0235192, C10H10N4O2S, CRL-8131 & Sulfadiazine, Sulfadiazine (JAN/USP/INN), Triple sulfa, 4-Amino-N-2-pyrimidinyl-benzenesulfonamide, AI3-01047, S. N. 112, 4-Amino-N-(2-pyrimidinyl)benzenesulfonamide, N-(2-Pyrimidinyl)sulfanilamide, SULFADIAZINE SODIUM, SEEPANYCNGTZFQ-UHFFFAOYSA-N, Trisulfapyrimidine, oral suspension, NSC35600, CAS-68-35-9, NCGC00016305-01, 0N7609K889, [(4-aminophenyl)sulfonyl]pyrimidin-2-ylamine, NSC117870, Recombinant bactericidal/permeability-increasing protein & Sulfadiazine, Sulfadiazine, Zinc, 141582-64-1, SMR000059113, SR-01000002973, Neotrizine (TN), Lantrisul (TN), Sulfadiazine,(S), Sulfaloid (TN), Sulfadiazine [USP:INN:BAN:JAN], Terfonyl (TN), DRG-0214, Prestwick_428, Sulfose (TN), Triple Sulfa (TN), Triple Sulfas (TN), Triple Sulfoid (TN), Spectrum_000986, Sulfadiazina Reig Jofre, Sulfacombin (Salt/Mix), AC1L1JUR, Prestwick0_000023, Prestwick1_000023, Prestwick2_000023, Prestwick3_000023, Spectrum2_001319, Spectrum3_001362, Spectrum4_000342, Spectrum5_000992, Sulfonamides Duplex (TN), Sulfa-Triple #2 (TN), D05LKP, Epitope ID:140083, AC1Q51XM, AC1Q6W1E, Sulfadiazine, >=99.0%, DSSTox_CID_24130, DSSTox_RID_80105, DSSTox_GSID_44130, Oprea1_081078, SCHEMBL24176, BSPBio_000085, BSPBio_002884, KBioGR_000743, KBioSS_001466, 5-25-10-00067 (Beilstein Handbook Reference), MLS000069423, MLS006011457, DivK1c_000543, SPECTRUM1500546, SPBio_001417, SPBio_002006, BPBio1_000095, WLN: T6N CNJ BMSWR DZ, DTXSID7044130, CTK7D7930, HMS501L05, KBio1_000543, KBio2_001466, KBio2_004034, KBio2_006602, KBio3_002104, MolPort-000-629-738, NINDS_000543, HMS1568E07, HMS1921A13, HMS2090P09, HMS2092I15, HMS2095E07, HMS2235D19, HMS3371L19, HMS3655I10, HMS3712E07, Pharmakon1600-01500546, ZINC120319, ALBB-014888, BCP12140, HY-B0273, Tox21_110360, BBL013169, BDBM50166571, CCG-39257, MFCD00006065, NSC-35600, NSC757324, s1770, SBB007604, SBB057674, STK317797, 2-(p-Aminobenzenesulfonamido)pyrimidin, AKOS000119073, CS-2263, DB00359, KS-1144, MCULE-4577338719, NE10425, NSC-757324, RP17586, 2-(4-Aminobenzenesulfonamido)pyrimidine, 4-amino-N-2-pyrimidylbenzenesulfonamide, IDI1_000543, N1-2(1H)-pyrimidinylidene-sulfanilamide, NCGC00016305-02, NCGC00016305-03, NCGC00016305-04, NCGC00016305-05, NCGC00016305-06, NCGC00016305-10, NCGC00023291-03, NCGC00023291-04, SULFADIAZINE (TRISULFAPYRIMIDINES), Sulfanilamide, N1-2-pyrimidinyl-(8CI), 2-(4-Aminobenzenesulfonylamino)pyrimidine, AC-26817, H458, ST059447, Sulfanilamide, N1-2-pyrimidinyl- (8CI), ZB004097, Mixture of sulfadiazine, and sulfamethazine, SBI-0051520.P003, AB2000282, KB-295527, LS-147838, 4-[[(Pyrimidin-2-yl)amino]sulfonyl]aniline, 4-Amino-N-2-pyrimidinyl- benzenesulfonamide, AB00052095, Benzenesulfonamide,4-amino-N-2-pyrimidinyl-, FT-0674741, R3929, S0579, ST51006797, TL80073596, 4-amino-N-(2-pyrimidinyl) benzenesulfonamide, 4-Amino-n-(2-pyrimidinyl)benzene-sulfonamide, 4-Amino-N-(2-pyrimidinyl)benzenesulfonamide #, 68S359, C07658, D00587, Trisulfapyrimidine, oral suspension (Salt/Mix), AB00052095-13, AB00052095-14, AB00052095_15, AB00052095_16, Benzenesulfonamide, 4-amino-N-(2-pyrimidinyl)-, Sulfadiazine, VETRANAL(TM), analytical standard, Q-201759, SR-01000002973-2, SR-01000002973-3, BRD-K32273377-001-05-4, BRD-K32273377-001-09-6, I01-15838, F1657-1720, I14-110269, Sulfadiazine, certified reference material, TraceCERT(R), Z271004844, Mixture of sulfadiazine, sulfamerazine, and sulfamethazine, Sulfadiazine, European Pharmacopoeia (EP) Reference Standard, Sulfadiazine, United States Pharmacopeia (USP) Reference Standard, Adiazin, Adiazine, Debenal, Liquadiazine, Microsulfon, Sulfazine, Sulfolex, Sulfadiazine, Sulfadiazine, Pharmaceutical Secondary Standard; Certified Reference Material, Sulfadiazine for identification of impurity F, European Pharmacopoeia (EP) Reference Standard


ID: 2069

chemical graph of compound 2069



InChIKey: SEEXPXUCHVGZGU-UHFFFAOYSA-M
SMILES: CC1=C(N(C(=C1)CC(=O)[O-])C)C(=O)C2=CC=C(C=C2)Cl.[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 47290
synonyms found at PubChem are:
Zomepirac sodium salt, Sodium zomepirac, ZOMEPIRAC SODIUM, Zomax, 64092-48-4, Zomepirac (sodium salt), Zomepirac sodium anhydrous, UNII-DA5B6IWF46, McN 2783-21-98, EINECS 264-669-2, DA5B6IWF46, 5-(4-Chlorobenzoyl)-1,4-dimethyl-1H-pyrrole-2-acetic acid sodium salt, NCGC00090751-01, Sodium 5-(4-chlorobenzoyl)-1,4-dimethyl-1H-pyrrole-2-acetate, CAS-64092-48-4, 1H-Pyrrole-2-acetic acid, 5-(4-chlorobenzoyl)-1,4-dimethyl-, sodium salt, DSSTox_CID_13989, DSSTox_RID_79106, DSSTox_GSID_33989, 5-(p-Chlorobenzoyl)-1,4-dimethylpyrrole-2-acetic acid Sodium-Potassium salt, SMR000686071, NCGC00094811-01, Prestwick_973, 1H-Pyrrole-2-acetic acid, 5-(4-chlorobenzoyl)-1,4-dimethyl-, sodium salt, dihydrate, Zomepirac Sodium (anhydrous), MLS001055441, MLS002153996, CHEMBL266459, C15H13ClNO3.2H2O.Na, DTXSID3033989, SCHEMBL11172041, CTK8G3888, MolPort-005-936-008, HMS1570K20, HMS2097K20, HMS3714K20, 33369-31-2 (Parent), HY-B0890, Tox21_111006, Tox21_111335, Tox21_202177, MFCD00057223, AKOS015962410, Tox21_111006_1, CCG-220779, CS-4353, MCULE-3654355863, NCGC00017126-01, NCGC00094811-06, NCGC00259726-01, AC-17496, LS-136555, FT-0675929, ST51015168, C-44302, sodium [5-(4-chlorobenzoyl)-1,4-dimethyl-1H-pyrrol-2-yl]acetate, sodium 2-(5-(4-chlorobenzoyl)-1,4-dimethyl-1H-pyrrol-2-yl)acetate, 2-{5-[(4-chlorophenyl)carbonyl]-1,4-dimethylpyrrol-2-yl}acetic acid, sodium sa lt, 65859-57-6


ID: 2070

chemical graph of compound 2070



InChIKey: SESFRYSPDFLNCH-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2345
synonyms found at PubChem are:
BENZYL BENZOATE, 120-51-4, Ascabiol, Benylate, Novoscabin, Benzoic acid, phenylmethyl ester, Ascabin, Scabitox, Scobenol, Benzyl phenylformate, Phenylmethyl benzoate, Benzoic acid, benzyl ester, Benzylets, Colebenz, Peruscabin, Scabagen, Scabanca, Scabiozon, Benzoic acid benzyl ester, Vanzoate, Scabide, Benzyl benzenecarboxylate, benzylbenzoate, Antiscabiosum, Benzylis benzoas, Benzyl alcohol benzoic ester, Peruscabina, Spasmodin, Venzonate, Benzylum benzoicum, Benzylester kyseliny benzoove, Benzoesaeurebenzylester, Caswell No. 082, Benzylbenzenecarboxylate, Venzoate, FEMA Number 2138, Benzyl benzoate (natural), NSC 8081, BENZOIC ACID PHENYLMETHYLESTER, UNII-N863NB338G, FEMA No. 2138, HSDB 208, EINECS 204-402-9, Benzylester kyseliny benzoove [Czech], EPA Pesticide Chemical Code 009501, BRN 2049280, CHEMBL1239, AI3-00523, CHEBI:41237, SESFRYSPDFLNCH-UHFFFAOYSA-N, N863NB338G, NCGC00094981-03, DSSTox_CID_9153, DSSTox_RID_78686, DSSTox_GSID_29153, Q-200696, Benzyl benzoate, analytical standard, Benzoate de benzyle, BZM, CAS-120-51-4, SMR000471875, benzylbenzoat, Benzyl benzoate [USP:JAN], Acarobenzyl, Benzevan, Benzyl benzoate [USAN:JAN], Benzyl benzoat, Benzyl ester, 1dzm, Benylate (TN), benzoic acid benzyl, Benzoesaurebenzylester, Spectrum_001240, Spectrum2_000532, Spectrum3_001757, Spectrum4_000773, Spectrum5_001128, Benzyl benzoate 99+ %, ACMC-1C8AP, WLN: RVO1R, D0G1VX, Benzyl benzoate, >=99%, EC 204-402-9, AC1L1DH0, SCHEMBL3038, BENZYL BENZOATE BP98, BSPBio_003494, KBioGR_001186, KBioSS_001720, 4-09-00-00307 (Beilstein Handbook Reference), KSC174Q0R, MLS001066412, MLS001336003, MLS001336004, DivK1c_000204, SPECTRUM1503002, SPBio_000543, Benzyl benzoate (JP17/USP), AC1Q661C, ZINC1021, DTXSID8029153, BENZOIC ACID,BENZYL ESTER, Benzyl benzoate, 99% 250g, CTK0H4808, HMS500K06, KBio1_000204, KBio2_001720, KBio2_004288, KBio2_006856, KBio3_002714, KS-00000UHX, NSC8081, MolPort-001-740-297, NINDS_000204, HMS1921P16, HMS2092F20, HMS2269D24, Pharmakon1600-01503002, HY-B0935, NSC-8081, Tox21_111372, Tox21_201337, Tox21_303418, ANW-17509, BDBM50134035, CCG-39578, MFCD00003075, NSC758204, s4599, SBB058609, STL183088, AKOS003495939, Benzyl benzoate, >=99%, FCC, FG, Tox21_111372_1, CHM0028580, DB00676, FCH2703790, LS-2573, MCULE-4369643785, NSC-758204, RL00855, RTR-003391, IDI1_000204, Benzyl benzoate, for synthesis, 99.0%, NCGC00094981-01, NCGC00094981-02, NCGC00094981-04, NCGC00094981-05, NCGC00094981-07, NCGC00257502-01, NCGC00258889-01, AC-17033, AN-22825, CC-24472, KB-75431, ZB000222, SBI-0051748.P002, Benzoic acid-benzyl ester (Benzyl benzoate), DB-041563, TR-003391, B0064, FT-0622708, ST50406335, Benzyl benzoate, natural, >=99%, FCC, FG, Benzyl benzoate, ReagentPlus(R), >=99.0%, Benzyl benzoate, SAJ first grade, >=98.0%, Benzyl benzoate, tested according to Ph.Eur., A19449, Benzyl benzoate, SAJ special grade, >=99.0%, C12537, D01138, AB00052298_07, Benzyl benzoate, Vetec(TM) reagent grade, 98%, Benzyl benzoate, meets USP testing specifications, C-24290, SR-01000763773, I14-6951, SR-01000763773-2, Benzoic acid-benzyl ester 5000 ng/microl in n-Hexane, BRD-K52072429-001-06-1, Benzoic acid benzyl ester; Benzoic acid phenylmethyl ester, Benzyl benzoate, certified reference material, TraceCERT(R), Benzyl benzoate, United States Pharmacopeia (USP) Reference Standard, Benzyl benzoate, Pharmaceutical Secondary Standard; Certified Reference Material, InChI=1/C14H12O2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H


ID: 2071

chemical graph of compound 2071



InChIKey: SEYCAKMZVYADRS-UHFFFAOYSA-N
SMILES: CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 17714
synonyms found at PubChem are:
Quotane, Quotane hydrochloride, Chinisocaine hydrochloride, Quinisocaine hydrochloride, Dimethisoquin hydrochloride [USAN], EINECS 220-468-1, Dimethisoquin HCl, 3-Butyl-1-(2-(dimethylamino)ethoxy)isoquinoline hydrochloride, 1-(beta-Dimethylaminoethoxy)-3-n-butylisoquinoline hydrochloride, 2-((3-Butyl-1-isoquinolyl)oxy)ethyl(dimethyl)ammonium chloride, 3-Butyl-1-(2-(dimethylamino)ethoxy)isoquinoline monohydrochloride, 1-(beta-Dimethylaminoethoxy)-3-n-butylisoquinoline monohydrochloride, ISOQUINOLINE, 3-BUTYL-1-(2-(DIMETHYLAMINO)ETHOXY)-, HYDROCHLORIDE, Ethanamine, 2-((3-butyl-1-isoquinolinyl)oxy)-N,N-dimethyl-, monohydrochloride, UNII-SMP2689462, SMP2689462, AC1L2AJ5, C17H24N2O.HCl, 86-80-6 (Parent), LS-85371, 2-(3-butylisoquinolin-1-yl)oxyethyl-dimethylazanium chloride, {2-[(3-butylisoquinolin-1-yl)oxy]ethyl}dimethylamine hydrochloride, Dimethisoquin hydrochloride, 2773-92-4, DSSTox_CID_25373, DSSTox_RID_80835, DSSTox_GSID_45373, NCGC00016618-01, CAS-2773-92-4, 2-(3-butylisoquinolin-1-yl)oxy-N,N-dimethylethanamine;hydrochloride, N-{2-[(3-butyl-1-isoquinolinyl)oxy]ethyl}-N,N-dimethylamine, MLS002153920, SCHEMBL467135, CHEMBL1533364, DTXSID6045373, HMS1569N22, Tox21_110528, AKOS024326188, Tox21_110528_1, CCG-220630, MCULE-5724448142, NCGC00016618-04, SMR000769826, KB-281896, D06661, SR-01000854196, SR-01000854196-2, 2-(3-butylisoquinolin-1-yl)oxy-N,N-dimethylethanamine,hydroc, 2-(3-butylisoquinolin-1-yl)oxy-N,N-dimethylethanamine,hydrochloride, 2-[(3-Butyl-1-isoquinolinyl)oxy]-N,N-dimethylethanamine hydrochloride, (2-(3-BUTYL-ISOQUINOLIN-1-YLOXY)-ETHYL)-DIMETHYL-AMINE, HYDROCHLORIDE


ID: 2072

chemical graph of compound 2072



InChIKey: SFAVZRNMTSBKPO-PFEQFJNWSA-N
SMILES: CN1CCC2=CC3=C(C4=C2[C@H]1CC5=CC=CC=C54)OCO3.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 44656911
synonyms found at PubChem are:
MolPort-000-716-723, MCULE-6609025744, Remerine HCl, 17669-16-8, REMERINEHYDROCHLORIDE, CHEMBL545513, MolPort-009-757-632, AKOS030489728, CCG-208369, ACM17669168


ID: 2073

chemical graph of compound 2073



InChIKey: SFBODOKJTYAUCM-UHFFFAOYSA-N
SMILES: CC(C)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3747
synonyms found at PubChem are:
ipriflavone, 35212-22-7, Osten, Yambolap, Osteofix, 7-Isopropoxyisoflavone, Iprosten, Ipriflavonum, Ipriflavona, Osteoquine, Quinogin, Ipriflavone [INN:JAN], 7-Isopropoxy-3-phenyl-4H-1-benzopyran-4-one, Osten (TN), Iprivone, Osteochin, TC 80, Ipriflavonum [INN-Latin], Ipriflavona [INN-Spanish], 7-(1-Methylethoxy)-3-phenyl-4H-1-benzopyran-4-one, UNII-80BJ7WN25Z, FL 113, FL-113, CCRIS 1920, MLS000069470, 3-phenyl-7-propan-2-yloxychromen-4-one, 7-isopropoxy-3-phenyl-4H-chromen-4-one, Ipriflavone (Osteofix), BRN 4754346, SMR000059060, 4H-1-Benzopyran-4-one, 7-(1-methylethoxy)-3-phenyl-, 80BJ7WN25Z, CHEBI:31719, SFBODOKJTYAUCM-UHFFFAOYSA-N, 3-phenyl-7-(propan-2-yloxy)-4H-chromen-4-one, NCGC00024094-04, DSSTox_CID_20679, DSSTox_RID_79537, DSSTox_GSID_40679, Ostivone, CAS-35212-22-7, Ipriflavon, (Ipriflavone), Ipriflavone, INN, 7-Isoproxyisoflavone, 7-isopropoxy-isoflavone, 7-Isopropoxy isoflavone, 7-isopropyloxy-isoflavone, AC1L1GME, AC1Q6AMH, Ipriflavone (JAN/INN), Opera_ID_1176, D0R2OA, Ipriflavone (JP17/INN), Cambridge id 6663564, cid_3747, Oprea1_106310, Oprea1_275552, MLS000759494, MLS001146879, MLS001424060, MLS006011644, SCHEMBL111472, 7-isopropoxy-3-phenyl-chromone, CHEMBL165790, ZINC4016, Ipriflavone, analytical standard, Jsp006346, DTXSID5040679, BDBM43662, CTK8B3043, SFBODOKJTYAUCM-UHFFFAOYSA-, MolPort-002-215-881, FL113, HMS2051J15, HMS2234M05, HMS3371E17, HMS3393J15, HMS3656K19, HMS3715D04, TC-80, TN-39, HY-N0094, Tox21_111532, Tox21_113172, ANW-41668, MFCD00221719, s2422, 7-Isopropoxy-3-phenyl-chromen-4-one, AKOS003627375, Tox21_111532_1, Tox21_113172_1, AC-8130, AN-8305, CCG-100963, CS-6395, MCULE-4241728982, NC00213, VA11103, KS-0000128C, 7-(methylethoxy)-3-phenylchromen-4-one, NCGC00018139-01, NCGC00018139-02, NCGC00018139-03, NCGC00018139-04, NCGC00018139-05, NCGC00018139-07, NCGC00018139-08, AS-12306, CC-29584, CPD000059060, LS-39792, SAM001246714, SC-76131, ST083683, ZB000555, 3-phenyl-7-propan-2-yloxy-chromen-4-one, AB1006726, FT-0621442, I0669, 3-phenyl-7-propan-2-yloxy-1-benzopyran-4-one, D01338, AB00384280-21, 212I227, C-17639, SR-01000000042, 7-Isopropoxy-3-phenyl-4H-1-benzopyran-4-one 97%, SR-01000000042-2, 7-Isopropoxy-3-phenyl-4H-1-benzopyran-4-one, 97%, F0196-0909, InChI=1/C18H16O3/c1-12(2)21-14-8-9-15-17(10-14)20-11-16(18(15)19)13-6-4-3-5-7-13/h3-12H,1-2H3


ID: 2074

chemical graph of compound 2074



InChIKey: SGDBTWWWUNNDEQ-LBPRGKRZSA-N
SMILES: C1=CC(=CC=C1C[C@@H](C(=O)O)N)N(CCCl)CCCl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 460612
synonyms found at PubChem are:
melphalan, 148-82-3, Alkeran, Melfalan, L-PAM, Phenylalanine mustard, L-Sarcolysine, L-Sarcolysin, L-Phenylalanine mustard, Levofalan, p-L-Sarcolysin, Levopholan, Melphalanum, Levofolan, Melfalano, Phenylalanine nitrogen mustard, 4-[Bis(2-chloroethyl)amino]-L-phenylalanine, p-Bis(beta-chloroethyl)aminophenylalanine, Alanine Nitrogen Mustard, p-Di-(2-chloroethyl)amino-L-phenylalanine, L-Sarkolysin, Melfalano [INN-Spanish], Melphalanum [INN-Latin], 3-(p-(Bis(2-chloroethyl)amino)phenyl)-L-alanine, p-N-Bis(2-chloroethyl)amino-L-phenylalanine, 4-(Bis(2-chloroethyl)amino)-L-phenylalanine, CB 3025, 3-p-(Di(2-chloroethyl)amino)-phenyl-L-alanine, L-3-(p-(Bis(2-chloroethyl)amino)phenyl)alanine, p-L-sarcolysine, Rcra waste number U150, NCI-C04853, CCRIS 374, UNII-Q41OR9510P, CB-3025, CHEBI:28876, (2S)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid, HSDB 3234, Melphalan [USAN:INN:BAN:JAN], At-290, NSC-8806, ALKERAN (TN), p-N,N-bis(2-chloroethyl)amino-L-phenylalanine, EINECS 205-726-3, CHEMBL852, RCRA waste no. U150, NSC 241286, BRN 2816456, L-3-(para-(Bis(2-chloroethyl)amino)phenyl)alanine, Sarcolysinum, SK-15673, phenylalanine nitrogen mu stard, SGDBTWWWUNNDEQ-LBPRGKRZSA-N, Q41OR9510P, p-N-Di(chloroethyl)aminophenylalanine, Alanine, 3-(p-(bis(2-chloroethyl)amino)phenyl)-, L-, Alanine, 3-[p-[bis(2-chloroethyl)amino]phenyl]-, L-, p-N-di(chloroethyl)aminophenylala nine, NCGC00090757-02, NSC 8806, DSSTox_CID_804, L-Phenylalanine, 4-(bis(2-chloroethyl)amino)-, 3-(p-(Bis(2-chloroethyl)amino)phenyl)alanine, 4-[Bis-(2-chloroethyl)amino]-L-phenylalanine, TRANSGENIC MODEL EVALUATION (MELPHALAN), DSSTox_RID_75797, DSSTox_GSID_20804, 8057-25-8, W-108096, TRANSGENIC LEP (MELPHALAN) (SEE ALSO MELPHALAN), Evomela, (S)-2-amino-3-(4-(bis(2-chloroethyl)amino)phenyl)propanoic acid, (2s)-2-amino-3-(4-[bis(2-chloroethyl)amino]phenyl)propanoic acid, MELPHALAN (SEE ALSO TRANSGENIC MODEL EVALUATION (MELPHALAN)), Melphalan-d8 Dihydrochloride, 4-(Bis(2-chloroethyl)amino)phenylalanine, NSC8806, CAS-148-82-3, SMR000058720, Phenylalanine, 4-[bis(2-chloroethyl)amino]-, L-Phenylalanine, 4-[bis(2-chloroethyl)amino]-, (2S)-2-amino-3-{4-[bis(2-chloroethyl)amino]phenyl}propanoic acid, NSC241286, Melphalan, powder, 4-[Bis(2-chloroethyl)amino]phenylalanine, Prestwick_1006, Melphalan [USAN:USP:INN:BAN:JAN], Spectrum_000397, 3025 C.B., AC1LA2OE, Spectrum2_000074, Spectrum3_000684, Spectrum4_000882, Spectrum5_001601, DL-Melphalan hydrochloride, D00FGO, Epitope ID:141802, SCHEMBL5872, BSPBio_002407, KBioGR_001284, KBioSS_000877, 4-14-00-01689 (Beilstein Handbook Reference), MLS001333666, MLS002153368, BIDD:GT0044, DivK1c_000653, SPECTRUM1500382, SPBio_000287, Melphalan (JP15/USP/INN), Melphalan (JP17/USP/INN), GTPL7620, ZINC1673, DTXSID6020804, NIOSH/AY3360000, CTK5E7915, HMS502A15, KBio1_000653, KBio2_000877, KBio2_003445, KBio2_006013, KBio3_001627, L-phenylalanine mustard (L-PAM), 3025 c.b, MolPort-003-665-535, NINDS_000653, HMS2090B09, HMS2091B16, HMS2235D21, Pharmakon1600-01500382, KS-00001D9Q, Tox21_111010, Tox21_202522, AN-976, BDBM50025837, CCG-39704, DL-442, LS-865, NSC757098, s8266, AKOS015895374, Alkeran;L-Phenylalanine mustard;L-PAM, Tox21_111010_1, API0003288, CS-3120, DB01042, NSC-757098, IDI1_000653, SMP2_000174, NCGC00090757-01, NCGC00090757-03, NCGC00090757-04, NCGC00090757-05, NCGC00090757-06, NCGC00260071-01, AS-13314, CC-30199, H877, HY-17575, LS-15868, SBI-0052787.P003, AB0005221, AB2000419, AY3360000, TL8001065, AY33600000, FT-0603357, 4-[bis(2-chloroethyl)-amino]-L-phenylalanine, 4-[bis(2-chloroethyl)-amino]-l-phenyl-alanine, 4-[bis(2-chloroethyl)amino]-(L)-phenylalanine, C07122, D00369, K-4728, AB00053282-07, AB00053282-08, AB00053282_09, 148M823, A808810, Alanine, 3-(p-(bis(2-chloroethyl)amino)phenyl)-, C-19011, SR-05000001667, SR-05000001667-1, BRD-K87827419-001-02-8, 2-amino-3-[4-bis(2-chloroethyl)amino]phenylpropanoic acid, UNII-A960M0G5TP component SGDBTWWWUNNDEQ-LBPRGKRZSA-N, 2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]-propanoic acid, (2S)-2-azanyl-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid, 2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid, (S)-2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid, 2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid(L-PAM), 2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid (Melphalan), 2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid(Melphalan), AC1OCG57, (2S)-2-azaniumyl-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate


ID: 2075

chemical graph of compound 2075



InChIKey: SGEWCQFRYRRZDC-VPRICQMDSA-N
SMILES: C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5280441
synonyms found at PubChem are:
Vitexin, 3681-93-4, Apigenin 8-C-glucoside, Vitxein, UNII-9VP70K75OK, 8-beta-D-Glucopyranosyl-apigenin, EINECS 222-963-8, 9VP70K75OK, Flavone, 8-D-glucosyl-4',5,7-trihydroxy-, CHEBI:16954, 8-beta-D-Glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-beta-D-glucopyranosyl-2-(4-hydroxyphenyl)-, 4H-1-Benzopyran-4-one, 8-beta-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-, 5,7-dihydroxy-8-beta-d-glucopyranosyl-2-(4-hydroxyphenyl)-4h-1-benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]chromen-4-one, Vitexin,(S), AC1NQX0Z, V0191, Vitexin, analytical standard, SCHEMBL25277, CHEMBL487417, CTK8F0956, DTXSID90190287, 4H-1-Benzopyran-4-one, 8-.beta.-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-, MolPort-003-935-138, SGEWCQFRYRRZDC-VPRICQMDSA-N, Apigenin 8-C-.beta.-D-glucoside, ACT02625, ZINC4245684, BDBM50362886, GC5761, MFCD00017456, AKOS025311479, AC-6086, CCG-208516, NCGC00163642-01, 521-33-5, AN-10375, LS-39593, SC-45938, (hydroxymethyl)tetrahydro-2H-pyran-2-yl)-, TR-035805, FT-0603644, N1319, C01460, 681V934, C-22262, Vitexin, primary pharmaceutical reference standard, Q-100437, 8-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-, 5,7,4'-Trihydroxyflavone 8-C-.beta.-D-glucopyranoside, Vitexin, United States Pharmacopeia (USP) Reference Standard, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-.beta.-D-glucopyranosyl-2-(4-hydroxyphenyl)-, 4H-1-Benzopyran-4-one,8-b-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-4H-chromen-4-one


ID: 2076

chemical graph of compound 2076



InChIKey: SGFCERQKVVMREN-UHFFFAOYSA-N
SMILES: CCC(C)C(=O)C1=C(C2=C(C(=C1O)C)OC3=C2C(=C(C(=C3C)O)C(=O)C(C)CC)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3270699
synonyms found at PubChem are:
RHODOMYRTOXIN B, KBio2_007472, Spectrum_001834, SpecPlus_000368, Spectrum2_001651, Spectrum3_001619, Spectrum4_001671, Spectrum5_000601, AC1MN2V8, BSPBio_003257, KBioGR_002221, KBioSS_002339, DivK1c_006464, SPECTRUM1504119, SPBio_001801, CHEMBL1552997, SCHEMBL12827333, CHEBI:91507, KBio1_001408, KBio2_002336, KBio2_004904, KBio3_002477, CCG-38767, SDCCGMLS-0066792.P001, NCGC00095684-01, NCGC00095684-02, BRD-A08003242-001-01-9, 2-methyl-1-[1,3,7,9-tetrahydroxy-4,6-dimethyl-8-(2-methylbutanoyl)dibenzofuran-2-yl]butan-1-one


ID: 2077

chemical graph of compound 2077



InChIKey: SGJNQVTUYXCBKH-HNQUOIGGSA-N
SMILES: C1=CC(=C(C=C1/C=C/C2=CC(=CC(=O)O2)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 54685921
synonyms found at PubChem are:
hispidin, 555-55-5, UNII-SSJ18CG55E, 6-(3,4-dihydroxystyrl)-4-hydroxy-2-pyrone, 6-[(E)-2-(3,4-dihydroxyphenyl)vinyl]-4-hydroxy-2H-pyran-2-one, 6-(3,4-Dihydroxystyryl)-4-hydroxy-2-pyrone, SSJ18CG55E, CHEBI:36332, 2-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-6-hydroxy-4-pyranone, (E)-6-(3,4-dihydroxystyryl)-4-hydroxy-2H-pyran-2-one, 6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2H-pyran-2-one, Hispidine, iso-Hispidin, AC1NS4G2, Lopac0_000634, 2-[2-(3,4-dihydroxyphenyl)ethenyl]-6-hydroxy-4h-pyran-4-one, SCHEMBL246649, CHEMBL1224512, SCHEMBL12305090, SCHEMBL16506390, CHEBI:131178, MolPort-003-941-572, HMS3261P10, Tox21_500634, Hispidin, solid, >=98% (HPLC), HSCI1_000157, MFCD01866972, AKOS015896249, AKOS030537191, ZINC100031035, CCG-204722, LP00634, QC-3972, SMP2_000346, NCGC00094001-01, NCGC00094001-02, NCGC00094001-03, NCGC00261319-01, EU-0100634, H 5257, A830701, SR-01000075911, I06-2124, SR-01000075911-1, BRD-K07325606-001-02-3, 4-hydroxy-6-(3,4-dihydroxystyryl)-2-pyrone (hispidine), 2-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-6-hydroxypyran-4-one, 6-[(E)-2-(3,4-dihydroxyphenyl)vinyl]-4-hydroxy-pyran-2-one, 2-[(E)-2-[3,4-bis(oxidanyl)phenyl]ethenyl]-6-oxidanyl-pyran-4-one, 2H-Pyran-2-one, 6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-


ID: 2078

chemical graph of compound 2078



InChIKey: SGMZJAMFUVOLNK-UHFFFAOYSA-M
SMILES: C[N+](C)(C)CCO.[Cl-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6209
synonyms found at PubChem are:
CHOLINE CHLORIDE, 67-48-1, Hepacholine, Biocolina, Biocoline, Lipotril, Paresan, Luridin chloride, Choline hydrochloride, Bilineurin chloride, (2-Hydroxyethyl)trimethylammonium chloride, Cholinium chloride, 2-Hydroxy-N,N,N-trimethylethanaminium chloride, Hormocline, Neocolina, Chloride de choline, Choline chlorhydrate, Choline, chloride, Cholinechloride, Cholini chloridum, Cloruro de colina, CHOLINE (CL), Chlorure de choline, Choline (chloride), Trimethyl(2-hydroxyethyl)ammonium chloride, Colina cloruro [DCIT], Choline chloride [INN], Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, chloride, (beta-Hydroxyethyl)trimethylammonium chloride, Chloride de choline [French], CCRIS 3716, Cholini chloridum [INN-Latin], HSDB 984, UNII-45I14D8O27, Cloruro de colina [INN-Spanish], Chlorure de choline [INN-French], Choline chloride solutions, EINECS 200-655-4, 2-Hydroxy-N,N,N,-trimethylethanaminium chloride, NSC 402838, (2-hydroxyethyl)trimethylazanium chloride, 2-hydroxyethyl(trimethyl)azanium chloride, AI3-18302, CHEMBL282468, Ammonium, (2-hydroxyethyl)trimethyl-, chloride, CHEBI:133341, 45I14D8O27, 2-hydroxyethyl(trimethyl)ammonium chloride, Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, chloride (1:1), Colina cloruro, 2-(trimethylamino)ethan-1-ol, chloride, NSC402838, SR-01000075745, C5H14NO.Cl, AC1LAWPE, Choline Chloride,(S), ACMC-1BFXK, DSSTox_CID_325, EC 200-655-4, DSSTox_RID_75513, DSSTox_GSID_20325, SCHEMBL14957, KSC352Q3D, 62-49-7 (Parent), SPECTRUM1503428, AC1L1M13, DTXSID4020325, CTK2F2831, HMS500F09, KS-00000VXT, Choline chloride, 98% 100g, MolPort-001-785-869, SGMZJAMFUVOLNK-UHFFFAOYSA-M, HMS1922E20, HMS2093G05, HMS3652D05, Pharmakon1600-01503428, HY-B1337, hydroxyethyltrimethylammonium chloride, Tox21_200492, ANW-35351, CCG-39465, MFCD00011721, NSC758473, s4171, SBB060960, AKOS015903458, CS-4855, LS-1563, MCULE-7472714268, NE10696, NSC-402838, NSC-758473, RP20572, RTR-022668, CAS-67-48-1, WLN: Q2K1&1&1 &Q &G, NCGC00095059-01, NCGC00095059-02, NCGC00258046-01, AN-23764, K112, SC-74396, AB1002139, DB-055035, TR-022668, B1703, FT-0612603, ST24040686, ST51037199, (2-H2-Hydroxyethyl)trimethylammonium chloride, (.beta.-Hydroxyethyl)trimethylammonium chloride, (2-oCOO>>u)Ey(1/4)x>>uAE>> i section sign, AB01568267_01, A835769, I14-1931, SR-01000075745-3, SR-01000075745-5, 1CDEFBD7-7905-4D2C-BEA8-44A54D9787D3, F8889-3032, (2-Hydroxyethyl)Trimethyl-Ammonium Chloride, 2-(chlorotrimethylamino)ethanol


ID: 2079

chemical graph of compound 2079



InChIKey: SGVZDMWHXVXUBY-KAIFKDDSSA-N
SMILES: COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 16219921
synonyms found at PubChem are:
Quinidine hydrochloride monohydrate, 6151-40-2, UNII-Z1PDY5DB92, QUINIDINE HYDROCHLORIDE, Z1PDY5DB92, Quinidine HCl, SMR000875291, Quinidine, monohydrochloride, monohydrate, MLS001333607, MLS001333608, MLS002154251, SCHEMBL1694760, CHEMBL1435413, CTK8E6870, MolPort-003-959-420, HY-B1302, Quinidine Hydrochloride, Monohydrate, Cinchonan-9-ol, 6'-methoxy-, monohydrochloride, monohydrate, (9S)-, AKOS025394776, Cinchonan-9-ol, 6'-methoxy-, hydrochloride, hydrate (1:1:1), (9S)-, CCG-220280, CS-8213, NCGC00180978-01, TX-017947, Quinidine hydrochloride monohydrate, technical grade, 6 inverted exclamation marka-Methoxycinchonan-9-ol hydrochloride monohydrate, (S)-(6-methoxyquinolin-4-yl)((2R,4S,5R)-5-vinylquinuclidin-2-yl)methanol hydrochloride hydrate


ID: 2080

chemical graph of compound 2080



InChIKey: SGXXNSQHWDMGGP-IZZDOVSWSA-N
SMILES: CN/C(=C\[N+](=O)[O-])/NCCSCC1=CSC(=N1)CN(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3033637
synonyms found at PubChem are:
nizatidine, 76963-41-2, Axid, Acinon, Zanizal, Nizax, Calmaxid, Cronizat, Distaxid, Galitidin, Naxidine, Nizatidina, Nizatidinum, Antizid, Gastrax, Nizaxid, Panaxid, Ulcosol, Ulxid, Zinga, Splendil ER, Axid Ar, Nizatidinum [Latin], Nizatidina [Spanish], LY-139037, Tazac, Niaztidine, Niatidine, Nizatidine [USAN:BAN:INN:JAN], ZE-101, ZL-101, Acinon (TN), Axid (TN), LY 139037, N-(2-(((2-((Dimethylamino)methyl)-4-thiazolyl)methyl)thio)ethyl)-N'-methyl-2-nitro-1,1-ethenediamine, SGXXNSQHWDMGGP-IZZDOVSWSA-N, 1,1-ethenediamine, n-[2-[[[2-[(dimethylamino)methyl]-4-thiazolyl]methyl]thio]ethyl]-n'-methyl-2-nitro-, N-(4-(6-Methylamino-7-nitro-2-thia-5-aza-6-hepten-1-yl)-2-thiazolylmethyl)-N,N-dimethylamin, (E)-N-(2-(((2-((dimethylamino)methyl)thiazol-4-yl)methyl)thio)ethyl)-N'-methyl-2-nitroethene-1,1-diamine, HSDB 3574, C12H21N5O2S2, BRN 4846056, (E)-1-N'-[2-[[2-(dimethylaminomethyl)-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine, (E)-N-[2-[[2-(dimethylaminomethyl)-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-N'-methyl-2-nitroethene-1,1-diamine, (E)-N-{2-[({2-[(dimethylamino)methyl]-1,3-thiazol-4-yl}methyl)thio]ethyl}-N'-methyl-2-nitroethene-1,1-diamine, 1,1-Ethenediamine, N-(2-(((2-((dimethylamino)methyl)-4-thiazolyl)methyl)thio)ethyl)-N'-methyl-2-nitro-, dimethyl[(4-{[(2-{[(E)-1-(methylamino)-2-nitroethenyl]amino}ethyl)sulfanyl]methyl}-1,3-thiazol-2-yl)methyl]amine, SMR000466384, CHEBI:7601, NCGC00016934-01, 1,1-Ethenediamine, N-(2-(((2-((dimethylamino)methyl)-4-thiazoly)methyl)thio)ethyl)-N'-methyl-2-nitro-, CAS-76963-41-2, Tazac;Axid;Axid AR, Tazac (TN), AC1Q1WQW, Prestwick2_000921, SCHEMBL769, SCHEMBL770, CHEMBL653, D0Q9DK, AC1MHW19, AC1Q40UA, LY-139037, Nizatidine, Nizatidine (JAN/USP/INN), MLS000759518, MLS001076680, MLS001424001, BIDD:GT0761, Nizatidine, analytical standard, GTPL7248, Nizatidine (JP17/USP/INN), MolPort-003-849-605, MolPort-027-655-252, HMS2051K04, HMS2094A15, HMS2235N05, Pharmakon1600-01505985, dimethyl[(4-{[(2-{[1-(methylamino)-2-nitroethenyl]amino}ethyl)sulfanyl]methyl}-1,3-thiazol-2-yl)methyl]amine, EBD34008, HY-B0310, ZINC1530736, NSC759289, AKOS015900643, AC-5272, CCG-100836, CS-2350, DB00585, HS-0083, NC00086, NE47126, NSC-759289, NCGC00016934-02, CPD000466384, LS-67650, SAM001246752, SC-15260, SBI-0206937.P001, AB0106214, AB2000352, C07270, D00440, AB00698253-07, AB00698253_09, 963N412, A838919, L000761, SR-01000765410, I14-0503, SR-01000765410-4, BRD-K73589491-001-05-4, BRD-K92193792-001-01-7, (E)-N-(2-((2-((dimethylamino)methyl)thiazol-4-yl)methylthio)ethyl)-N-methyl-2-nitroethene-1,1-diamine, (E)-N1'-[2-[[2-[(dimethylamino)methyl]-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-N1-methyl-2-nitro-ethene-1,1-diamine, (E)-N1'-[2-[[2-[(dimethylamino)methyl]-4-thiazolyl]methylthio]ethyl]-N1-methyl-2-nitroethene-1,1-diamine, 1,1-Ethenediamine, N'-[2-[[[2-[(dimethylamino)methyl]-4-thiazolyl]methyl]thio]ethyl]-N-methyl-2-nitro-, N-(4-(6-Methylamino-7-nitro-2-thia-5-aza-6-hepten-1-yl)-2-thiazolylmethyl)-N,N-dimethylamine, N-{2-[({2-[(dimethylamino)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]ethyl}-N'-methyl-2-nitroethene-1,1-diamine


ID: 2081

chemical graph of compound 2081



InChIKey: SGZRQMALQBXAIQ-UHFFFAOYSA-N
SMILES: CC(CC1=CC=C(C=C1)O)NCC(C2=CC(=CC(=C2)O)O)O.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 16037
synonyms found at PubChem are:
TH 1165A, EINECS 217-742-8, 5-(1-Hydroxy-2-((2-(4-hydroxyphenyl)-1-methylethyl)amino)ethyl)resorcinol hydrobromide, 1-(3,5-Dihydroxy-phenyl)-2-((1-(4-hydroxybenzyl)ethyl)amino)-ethanol hydrobromide, AC1Q1RJP, Benzyl alcohol, 3,5-dihydroxy-alpha-(((p-hydroxy-alpha-methylphenethyl)amino)methyl)-, hydrobromide, AC1L274R, AN-17358, LS-42859, [2-(3,5-dihydroxyphenyl)-2-hydroxyethyl]-[1-(4-hydroxyphenyl)propan-2-yl]azanium bromide, 1,3-Benzenediol, 5-(1-hydroxy-2-((2-(4-hydroxyphenyl)-1-methylethyl)amino)ethyl)-, HBr, [2-(3,5-dihydroxyphenyl)-2-hydroxy-ethyl]-[2-(4-hydroxyphenyl)-1-methyl-ethyl]ammonium bromide, 5-(1-hydroxy-2-{[1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl)benzene-1,3-diol hydrobromide(1:1), Fenoterol hydrobromide, 1944-12-3, fenoterol HBr, Fenoterol (hydrobromide), Fenoterol bromide, Phenoterol hydrobromide, Partusisten, CHEBI:31601, Berotec (TN), DSSTox_CID_25419, DSSTox_RID_80867, DSSTox_GSID_45419, Fenoterol hydrobromide (JAN), Fenoterol hydrobromide [JAN], CHEMBL537445, 2-(3,5-Dihydroxyphenyl)-2-hydroxy-2'-(4-hydroxyphenyl)-1'-methyldiethylamine hydrobromide, CAS-1944-12-3, SR-01000075873, Fenoterol-d6, 5-(1-hydroxy-2-(1-(4-hydroxyphenyl)propan-2-ylamino)ethyl)benzene-1,3-diol hydrobromide, 5-[1-hydroxy-2-[1-(4-hydroxyphenyl)propan-2-ylamino]ethyl]benzene-1,3-diol hydrobromide, Prestwick_667, AC1NWASK, NCGC00016721-01, MLS001056741, ARONIS24570, SCHEMBL121549, SPECTRUM1501007, DTXSID5045419, CTK8F9746, HY-B0976A, BBC/743, MolPort-003-666-344, REGID_for_CID_5702161, SGZRQMALQBXAIQ-UHFFFAOYSA-N, HMS1568J06, HMS1921B11, Pharmakon1600-01501007, 13392-18-2 (Parent), BCP28959, ZX-AS004943, Tox21_110581, Tox21_500544, BG0190, CCG-38987, NSC757811, AKOS015909691, Tox21_110581_1, API0002690, CS-5285, KS-5090, LP00544, NSC-757811, NCGC00015430-06, NCGC00093932-01, NCGC00093932-02, NCGC00093932-03, NCGC00093932-04, NCGC00261229-01, S314, SMR000326705, ACM1286129041, EU-0100544, FT-0668501, ST51015001, VU0243157-4, D01428, F 1016, C-54957, J-012593, SR-01000075873-1, SR-01000075873-6, I14-31833, Fenoterol hydrobromide, European Pharmacopoeia (EP) Reference Standard, 2-[3,5-Dihydroxyphenyl]-2- hydroxy-2 -[4-hydroxyphenyl]- 1 -methyldiethylamine, 5-(1-hydroxy-2-{[1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl)benzene-1,3-diol hydrobromide, 5-(1-hydroxy-2-{[2-(4-hydroxyphenyl)-isopropyl]amino}ethyl)benzene-1,3-diol, b romide, Fenoterol for peak identification, European Pharmacopoeia (EP) Reference Standard, 1,3-Benzenediol, 5-(1-hydroxy-2-((2-(4-hydroxyphenyl)-1-methylethyl)amino)ethyl)-, HBr (9CI), 2-(3,5-Dihydroxyphenyl)-2-hydroxy-2 inverted exclamation marka-(4-hydroxyphenyl)-1 inverted exclamation marka-methyldiethylamine hydrobromide


ID: 2082

chemical graph of compound 2082



InChIKey: SHAYBENGXDALFF-UHFFFAOYSA-N
SMILES: CNCCC=C1C2=CC=CC=C2CCC3=CC=CC=C31.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 13468
synonyms found at PubChem are:
Psychostyl, Acetexa, Allegron, Altilev, Nortrilen, Norzepine, Pamelor, Sensival, Vividyl, Aventyl allegron, Nortriptyline Hcl, Ateben hydrochloride, Nortab hydrochloride, Aventyl hydrochloride, Pamelor hydrochloride, Nortriptylin hydrochloride, Lilly 38489, HSDB 3371, EINECS 212-973-0, NSC 78248, NSC 169453, 5-(3-(Methylamino)propylidene)dibenzo(a,e)cyclohepta(1,5)diene hydrochloride, 5-(3-Methylaminopropylidene)-10,11-dihydro-5H-dibenzo(a,d)cycloheptene hydrochloride, AC1Q1RWX, 1-Propanamine, 3-(10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-ylidene)-N-methyl-, hydrochloride, 10,11-Dihydro-N-methyl-5H-dibenzo(a,d)cycloheptene-delta(sup 5,gamma)-propylamine hydrochloride, 5H-Dibenzo(a,d)cycloheptene-delta(sup 5),gamma-propylamine, 10-11-dihydro-N-methyl-, hydrochloride, AC1L21SL, Nortriptyline hydrochloride [USAN:JAN], LS-60755, 5H-Dibenzo(a,d)cycloheptene-delta(sup 5),gamma-propylamine, 10-11-dihydro-N-methyl-,hydrochloride, Nortriptyline hydrochloride, 894-71-3, Desmethylamitriptyline hydrochloride, Nortriptyline (hydrochloride), UNII-00FN6IH15D, Noramitriptyline hydrochloride, Nortriptyline monohydrochloride, MLS000069673, 00FN6IH15D, N 7048, CPD000058486, SMR000058486, Pamelor (TN), EN300-26665, 3-(10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-N-methyl-1-propanamine Hydrochloride, W-109609, 3-(10,11-Dihydro-5H-dibenzo[a,d]-cyclohepten-5-ylidene)-N-methyl-1-propanamine, WLN: L C676 BY&T&J BU3M1 &GH, NSC78248, NSC169453, NSC-169453, SR-01000000223, CAS-894-71-3, 5-[3-(Methylamino)propylidene]dibenzo[a,5]diene hydrochloride, (2)10,d]cycloheptene-.delta.5.gamma.-propylamine, hydrochloride, 5-[(3-(Methylamino)propylidene]-10,d]cycloheptene hydrochloride, NORTRIPTYLINEHYDROCHLORIDE, 5H-Dibenzo[a,.gamma.-propylamine, 10,11-dihydro-N-methyl-, hydrochloride, 5H-Dibenzo[a,.gamma.-propylamine, 10-11-dihydro-N-methyl-, hydrochloride, 1-Propanamine,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-N-methyl-, hydrochloride, 3-(5,6-dihydrodibenzo[2,1-b:1',2'-e][7]annulen-11-ylidene)-N-methylpropan-1-amine;hydrochloride, Prestwick_366, Nortriptyline hdrochloride, Nortriptyline hydrochloride [USAN:USP:JAN], Opera_ID_1915, AC1Q3BS4, DSSTox_CID_25109, DSSTox_RID_80676, DSSTox_GSID_45109, SCHEMBL41329, MLS001077267, MLS002222206, MLS006010656, 72-69-5 (free base), AC1L9B17, CHEBI:7641, CHEMBL1201156, DTXSID2045109, REGID_for_CID_441358, CTK8G2012, AOB5370, MolPort-003-959-040, SHAYBENGXDALFF-UHFFFAOYSA-N, HMS1568D10, HY-B1417, KS-000017PT, Tox21_110048, Tox21_500868, BG0274, MFCD00058024, NSC-78248, AKOS015889095, API0003634, CCG-212718, CS-4913, KS-1306, LP00868, NC00522, NE48409, NCGC00014483-01, NCGC00094192-01, NCGC00094192-02, NCGC00261553-01, 1-Propanamine, 3-(10,11-dihydro-5H-dibenzo[ a,d]cyclohepten-5-ylidene)-N-methyl-, hydrochloride, SAM002554915, EU-0100868, FT-0673146, N0957, Nortriptyline hydrochloride (JP17/USP/INN), D00816, N 7261, C-46080, Nortriptyline hydrochloride, >=98% (TLC), powder, SR-01000000223-2, SR-01000000223-7, I01-17298, Nortriptyline Hydrochloride 1.0 mg/ml in Methanol (as free base), Nortriptyline hydrochloride, British Pharmacopoeia (BP) Reference Standard, Nortriptyline hydrochloride, European Pharmacopoeia (EP) Reference Standard, 10,11-Dihydro-5-(N-methyl-3-aminopropylidene)-5H-dibenzo[a,d]cycloheptene Hydrochloride, 3-(10,11-2H-5H-dibenzo[a,d][7]annulen-5-ylidene)-N-methyl-1-propanaminium chloride, Nortriptyline for system suitability, European Pharmacopoeia (EP) Reference Standard, Nortriptyline hydrochloride, United States Pharmacopeia (USP) Reference Standard, 37025-22-2, 8057-32-7, methyl(3-{tricyclo[9.4.0.0?,?]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}propyl)amine hydrochloride, N-[3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)propyl]-N-methylamine hydrochloride, AC1LCW73, AKOS026750086


ID: 2083

chemical graph of compound 2083



InChIKey: SHDSXTLKCOGMKJ-ONDCXVNZSA-N
SMILES: C[C@@H]1CC[C@]23CCC4([C@@]5(CCC6[C@@](C5C=C[C@@]4(C2[C@H]1C)OC3=O)(CCC(=O)C6(C)C)C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6708660
synonyms found at PubChem are:
3-OXOURSAN (28-13)OLIDE, Spectrum_001361, SpecPlus_000365, Spectrum2_001781, Spectrum3_001293, Spectrum4_001732, Spectrum5_000524, BSPBio_002925, KBioGR_002144, KBioSS_001841, SPECTRUM307047, DivK1c_006461, SPBio_001701, CHEMBL3039031, KBio1_001405, KBio2_001841, KBio2_004409, KBio2_006977, KBio3_002145, CCG-38430, SDCCGMLS-0066902.P001, NCGC00178388-01, SR-05000002682, SR-05000002682-1


ID: 2084

chemical graph of compound 2084



InChIKey: SHGAZHPCJJPHSC-XFYACQKRSA-N
SMILES: CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C\C(=O)O)/C)/C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5282379
synonyms found at PubChem are:
Isotretinoin, 13-cis-Retinoic acid, Accutane, Roaccutane, Claravis, Neovitamin A acid, 13-cis-Vitamin A acid, 4759-48-2, Amnesteem, Isotrex, Teriosal, Sotret, Roaccutan, 13-cis retinoic acid, isotretinoino, Isotretinoine, Isotretinoinum, 13-RA, Absorica, Isotane, Roacutan, Isotretinoine [INN-French], Isotretinoinum [INN-Latin], Isotretinoino [INN-Spanish], CIP-Isotretinoin, RETINOIC ACID, 13-cis-, Accutane (TN), Isotretinoin (USP), 13 cis retinoic acid, UNII-EH28UP18IF, cis-Retinoic acid, Ro 4-3780, Ro-4-3780, Sotret (TN), ISORETINOIN, ISOTRETINON, CCRIS 4286, Isotretinoin [USAN:INN:BAN], HSDB 3929, 13 Cis-Retinoic Acid, (13cis)-retinoic acid, 13-cis RA, EINECS 225-296-0, Ro-43780, (7E,9E,11E,13Z)-retinoic acid, CHEMBL547, BRN 1885770, EH28UP18IF, BML2-E07, CHEBI:6067, 13-cis-retinoic acid,Isotretinoin, SHGAZHPCJJPHSC-XFYACQKRSA-N, (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)2-cis-4-trans-6-trans-8-trans-nonatetraenoic acid, CPD000471891, Isotretinoin Retinoic acid, R 3255, (2Z,4E6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, Myorisan, Zenatane, Isosuprea Lidose, (2Z,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic Acid, (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, SR-01000076103, accure, isotretinoina, cis-Retinoate, Isotretinoin [USAN:BAN:INN], cis retinoic acid, Roaccutane (TN), Amnesteem (TN), cis-RA, Absorica (TN), Prestwick_642, CAS-4759-48-2, Claravi (TN), Decutan (TN), Isotane (TN), Isotretinoin [USAN:USP:INN:BAN], Oratane (TN), Clarus (TN), Izotek (TN), Ro 43780, ISOTREXGEL, Isotretinoin Zinc Salt, 13 cis Isomer, Isotretinoin Zinc Salt, 13-cis-Isomer, Ro 4 3780, (13-cis)-Retinoate, AC1NQZZ4, 13cRA, Prestwick2_000256, Prestwick3_000256, Spectrum5_001795, Spectrum5_001937, (13-cis)-Retinoic acid, DSSTox_CID_3177, D00DKK, Retinoic acid, (13cis)-, DSSTox_RID_76906, DSSTox_GSID_23177, Lopac0_001081, SCHEMBL38299, BSPBio_000072, BSPBio_001331, BSPBio_003345, 4-09-00-02388 (Beilstein Handbook Reference), MLS001074662, SPECTRUM1502013, BPBio1_000080, GTPL7600, DTXSID4023177, MolPort-003-666-394, HMS1361C13, HMS1568D14, HMS1791C13, HMS1921D08, HMS1989C13, HMS2092N07, HMS2095D14, HMS2233A07, HMS3259J09, HMS3263I04, HMS3402C13, HMS3712D14, Pharmakon1600-01502013, BCP18950, ZINC3792789, Tox21_200093, Tox21_501081, BDBM50031459, LMPR01090021, NSC758156, AKOS015841158, AB03039, CCG-205158, CS-1864, DB00982, DS-3367, LP01081, NC00635, NSC-758156, RP17638, IDI1_033801, NCGC00094358-01, NCGC00094358-02, NCGC00094358-03, NCGC00094358-04, NCGC00094358-05, NCGC00094358-06, NCGC00094358-07, NCGC00094358-08, NCGC00094358-09, NCGC00094358-10, NCGC00094358-11, NCGC00094358-12, NCGC00094358-13, NCGC00094358-14, NCGC00094358-15, NCGC00257647-01, NCGC00261766-01, AN-15746, CC-29726, HY-15127, SAM002548955, SC-18589, SMR000471891, 13-cis-Retinoic acid, >=98% (HPLC), 13-cis-Retinoic acid|||Retinoid analogues, SBI-0051051.P003, LS-143465, EU-0101081, R0088, 5952-EP0930075A1, 5952-EP2295426A1, 5952-EP2311840A1, 59I482, C07058, D00348, 24210-EP2311808A1, 24210-EP2311829A1, 24210-EP2314590A1, SR-01000076103-2, SR-01000076103-5, SR-01000076103-6, SR-01000076103-9, BRD-K76723084-001-05-9, I14-16776, SR-01000076103-10, Isotretinoin, European Pharmacopoeia (EP) Reference Standard, Isotretinoin, United States Pharmacopeia (USP) Reference Standard, (2Z,4E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)-2,4,6,8-nonatetraenoic acid, Isotretinoin for peak identification, European Pharmacopoeia (EP) Reference Standard, Isotretinoin, Pharmaceutical Secondary Standard; Certified Reference Material, (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid, (2Z,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-cyclohex-1-enyl)-nona-2,4,6,8-tetraenoic acid, 3,7-DIMETHYL-9-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-2-CIS-4-TRANS-6-TRANS-8-TRANS-NONATETRAENOIC ACID, 3,7-DIMETHYL-9-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-2Z,4E,6E,8E-NONATETRANENOIC ACID


ID: 2085

chemical graph of compound 2085



InChIKey: SHGAZHPCJJPHSC-YCNIQYBTSA-N
SMILES: CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)O)/C)/C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 444795
synonyms found at PubChem are:
Retinoic acid, tretinoin, 302-79-4, all-trans-Retinoic acid, Vitamin A acid, trans-Retinoic acid, Airol, Retin-A, ATRA, Vesanoid, Renova, Dermairol, Aknoten, Aberel, Eudyna, all-trans-Vitamin A acid, Aknefug, Cordes vas, Epi-aberel, All-trans Retinoic Acid, Atralin, Tretin M, Vitamin A1 acid, all-trans-, Retin-A Micro, all-trans-Vitamin A1 acid, all-trans-Tretinoin, Vitamin A acid, all-trans-, Effederm, Retionic acid, Retinoic acid, all-trans-, Alltrans-retinoic acid, beta-Ra, Aberela [Norway], all-(E)-Retinoic acid, Avitoin [Norway], beta-Retinoic acid, All Trans Retinoic Acid, Acnavit [Denmark], Effederm [France], Aberela, Acnavit, Avitoin, Betarretin, Retacnyl, Tretinoino, TRETINON, Vesnaroid, Ro 1-5488, A-Acido (Argentina), A-Vitaminsyre, Tretinoin, all-trans-, Cordes VAS [Germany], Retin A, Stieva-A, A-Vitaminsyre [Denmark], (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, NSC-122758, Tretinoine [INN-French], Tretinoinum [INN-Latin], Tretinoina [INN-Spanish], Tretinoino [INN-Spanish], Retinoate, Tretinoine, .beta.-Retinoic acid, all trans-Retinoic acid, Nexret, Vitamin a acid, trans-, Tretinoin/All-Trans Retinoic Acid, Avita Gel, 15-Apo-beta-caroten-15-oic acid, tretinoin liposome, Acid A Vit (Belgium, Netherlands), all-trans-beta-Retinoic acid, Tretinoinum, Tretinoina, Tretinoin [USAN:INN:BAN], [3H]Retinoic acid, UNII-5688UTC01R, Renova (TN), 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid, CCRIS 3294, Avita (TN), MLS000028588, b-Retinoic acid, HSDB 2169, AT-RA, CHEMBL38, all-trans-Retinoate, (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-tetraenoic acid, (all-E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid, 2,4,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (all-E)-, EINECS 206-129-0, NSC122758, all-trans-b-Retinoic acid, NSC 122758, BRN 2057223, Tretinoin (JAN/USP/INN), Atragen, Retinova, SMR000058245, BML2-E05, tretinoine (French) (EINECS), Acid, Retinoic, RETINOIC ACID, ALL TRANS, Retisol-A, CHEBI:15367, Tretinoin 0.1% cream or placebo, Acid, Vitamin A, Acide retinoique (French) (DSL), SHGAZHPCJJPHSC-YCNIQYBTSA-N, 5688UTC01R, Tretinoin (TN), trans Retinoic Acid, Tretinoin Zinc Salt, (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid, Acid, trans-Retinoic, REA, Salt, Tretinoin Zinc, Zinc Salt, Tretinoin, PDT-002-002, 9-cis-RA, Retin A (TN), NCGC00017280-10, CPD000058245, DSSTox_CID_1239, R 2625, AGN 100335, 3,7-Dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-all-trans-tetraenoic acid, DSSTox_RID_76031, DSSTox_GSID_21239, trans-Retinoate, beta-Retinoate, Refissa, Vesanoid (TN), 4759-48-2, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexene-1-yl)-2,4,6,8-nonatetraenoic acid (ECL), 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid, 3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2E,4E,6E,8E-tetraenoic acid, (11Z)-retinoic acid, Isotretinoin;(2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, Tretinoin Sodium Salt, Salt, Tretinoin Sodium, Sodium Salt, Tretinoin, SR-01000000239, Tretinoin Potassium Salt, Acid, all-trans-Retinoic, Potassium Salt, Tretinoin, Salt, Tretinoin Potassium, beta-all-trans-Retinoic acid, beta all trans Retinoic Acid, Acid, beta-all-trans-Retinoic, TNP00194, tretinoin sodium, 1cbr, [3H]tretinoin, [All-E]-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid, Trans-Retinoicacid, Tretinoin [USAN:USP:INN:BAN], tretinoin potassium, (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-tetr aenoic acid, CAS-302-79-4, Prestwick_424, Aberela (TN), all-(E)-Retinoate, Tretinoine (French), Retinoic acid, cis-, Stieva-A (TN), (5E)-Retinoic acid, 9-trans-retinoic acid, [3H]Vitamin A acid, Retin-A (TN), PubChem16466, 1n4h, Retinoic acid all trans, Isotretinoin Retinoicacid, 6-s-trans-retinoic acid, AC1L9GWO, Opera_ID_1055, Prestwick2_000257, Prestwick3_000257, Spectrum5_001746, Spectrum5_001933, acide retinoique (French), Vesanoid (TN) (Roche), Tretinoin (Retinoic acid), Tretinoin - Retinoic Acid, bmse000562, D02DGU, D0A8ND, UPCMLD-DP097, AC1Q1J2J, Renova (0.02% cream), SCHEMBL3145, (9Z,13Z)-Retinoic acid, Altreno (0.05% lotion), BIDD:PXR0081, Lopac0_001061, Avita (0.025% gel), BSPBio_000074, BSPBio_001500, MLS001076515, MLS002207234, MLS002222211, MLS002548861, MLS006010222, ARONIS25153, BIDD:GT0483, SPECTRUM1502016, 9-cis-retinoic acid (9cRA), [3H]RA, BPBio1_000082, cid_444795, GTPL2644, .beta.-all-trans-Retinoic acid, all-trans-retinoic acid (ATRA), DTXSID7021239, Retinoic acid, 98% 250mg, SCHEMBL19091395, BDBM31883, HMS502N05, QCR-120, Retinoic acid, all-trans-(8CI), MolPort-000-883-857, BCPP000036, HMS1361K22, HMS1568D16, HMS1791K22, HMS1921D14, HMS1989K22, HMS2089D20, HMS2092N11, HMS2095D16, HMS2236N03, HMS3259E11, HMS3263E04, HMS3402K22, HMS3712D16, Pharmakon1600-01502016, Retinoic acid, all-trans- (8CI), ACT00012, BCP01405, Tox21_110812, Tox21_202330, Tox21_300305, Tox21_501061, AGN100335, All-trans Retinoic Acid (Tretinoin), CCG-39912, LMPR01090019, MFCD00001551, NSC759631, s1653, SBB065722, ZINC12358651, 13497-05-7 (hydrochloride salt), AKOS000280845, Tox21_110812_1, AC-6824, AN-9660, CS-1269, GS-3578, LP01061, LS-1154, NC00481, NSC-759631, RP17637, IDI1_000903, IDI1_033970, NCGC00017280-05, NCGC00017280-06, NCGC00017280-07, NCGC00017280-08, NCGC00017280-09, NCGC00017280-12, NCGC00017280-15, NCGC00017280-16, NCGC00017280-17, NCGC00017280-18, NCGC00017280-19, NCGC00017280-20, NCGC00017280-23, NCGC00021808-04, NCGC00021808-05, NCGC00021808-06, NCGC00021808-07, NCGC00021808-09, NCGC00021808-11, NCGC00021808-14, NCGC00021808-15, NCGC00254179-01, NCGC00259879-01, NCGC00261746-01, trans-Retinoic acid|||Retinoid analogues, AJ-61307, BC202905, BP-20401, BR-73126, HY-14649, KB-66303, Retinoic acid, >=98% (HPLC), powder, SAM002264647, SC-16932, ST057075, SBI-0051031.P003, AB1009361, ST2407905, EU-0101061, R0064, 02T794, 5914-EP2275412A1, 5914-EP2292576A2, C00777, D00094, J10054, S-1635, 33998-EP2275420A1, 33998-EP2295055A2, 33998-EP2295416A2, 33998-EP2295426A1, 33998-EP2295427A1, 33998-EP2298748A2, 33998-EP2298764A1, 33998-EP2298765A1, 33998-EP2298768A1, 33998-EP2301928A1, 33998-EP2305642A2, 33998-EP2308833A2, 33998-EP2308861A1, 33998-EP2311453A1, 33998-EP2311808A1, 33998-EP2311829A1, 33998-EP2311840A1, AB00052318-15, AB00052318-16, AB00052318-17, AB00052318_18, AB00052318_19, L000833, I04-0008, I14-2351, Q-200610, SR-01000000239-3, SR-01000000239-4, SR-01000000239-6, SR-01000000239-7, BRD-K06926592-001-01-7, BRD-K71879491-001-15-0, BRD-K71879491-001-22-6, SR-01000000239-12, SR-01000000239-13, SR-01000000239-14, SR-01000000239-15, WLN: L6UTJ A1 B1U1Y1&U2U1Y1&U1VQ C1 C1, ATRA; Tretinoin; Vitamin A acid; all-trans-Retinoic acid, Tretinoin, European Pharmacopoeia (EP) Reference Standard, WLN: L6UTJ A1 B1U1Y1 & U2U1Y1 & U1VQ C1 C1, Tretinoin, United States Pharmacopeia (USP) Reference Standard, Vesanoid, Airol, Renova, Atralin, Retin-A, Avita, Tretinoin, 3,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid, Tretinoin, Pharmaceutical Secondary Standard; Certified Reference Material, (2E,4E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)-2,4,6,8-nonatetraenoic acid, (4E,6E,8E)-9-(2,6,6-Trimethyl-1-cyclohexenyl)-3,7-dimethyl-2,4,6,8-nonatetraenoic acid, (all-E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate, 2,4,6,8-Nonatetranoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, 2,6,8-Nonatetranoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2E,4E,6E,8E,-nonatetraenoic acid, all-trans-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic Acid, (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-cyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, 187175-63-9, 2,4, 6,8-Nonatetranoic acid, 3,7-dimethyl-9-(2,6, 6-trimethyl-1-cyclohexen-1-yl)-, (2E, 4E, 6E, 8E)-, 2,4,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)--, (all trans)-, 2,4,6,8-Nonatetranoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (all trans)-, 2,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (all-E)-, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid-, (all trans)-, 56573-65-0, 7005-78-9, 97950-17-9


ID: 2086

chemical graph of compound 2086



InChIKey: SHIBSTMRCDJXLN-KCZCNTNESA-N
SMILES: C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2C[C@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 15478
synonyms found at PubChem are:
Digoxigenin, 1672-46-4, Lanadigenin, Digoxigenine, UNII-NQ1SX9LNAU, CHEBI:42098, HSDB 7108, NQ1SX9LNAU, EINECS 216-806-2, BRN 0096479, 3-beta,12-beta,14-Trihydroxy-card-20(22)-enolide, 3-beta,12,14-Trioxy-digen-(20:22)-olid [German], 3-beta,12,14-Trioxy-carden-(20:22)-olid [German], 3beta,12beta,14-trihydroxy-5beta-card-20(22)-enolide, Cardogenen-(20:22)-triol-(3-beta,12,14) [German], (3beta,5beta,12beta)-3,12,14-Trihydroxycard-20(22)-enolide, delta-sup(20:22)-3-beta,12-beta,14,21-Tetrahydroxynorcholenic acid lactone, 5-beta-CARD-20(22)-ENOLIDE, 3-beta,12-beta,14-TRIHYDROXY-, 3-[(3S,5R,8R,9S,10S,12R,13S,14S,17R)-3,12,14-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one, 4-(3,12,14-TRIHYDROXY-10,13-DIMETHYL-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-17-YL)-5H-FURAN-2-ONE, SR-01000841253, Lanadigigenin, 1lke, 3|A-Digoxigenin, CAS-1672-46-4, 4j8t, 4j9a, Prestwick0_000883, Prestwick1_000883, Prestwick2_000883, Prestwick3_000883, bmse000735, Epitope ID:180303, 3-beta,12,14-Trioxy-carden-(20:22)-olid, 3-beta,12,14-Trioxy-digen-(20:22)-olid, CHEMBL1153, DSSTox_CID_30333, DSSTox_GSID_51778, SCHEMBL21105, BSPBio_000666, 5-18-04-00380 (Beilstein Handbook Reference), MLS002154050, SPBio_002885, AC1L25Z9, AC1Q69N3, BPBio1_000734, CARDOGENEN-(20:22)-TRIOL-(3-beta,12,14), Digoxigenin, analytical standard, DTXSID6051778, CTK8F9202, MolPort-004-955-165, SHIBSTMRCDJXLN-KCZCNTNESA-N, BDBM225707, CS337, HMS1570B08, HMS2097B08, HMS2233P09, HMS3714B08, HY-B1025, ZINC3982471, Tox21_303893, 2376AH, LMST01120008, AKOS015915909, CCG-220883, CS-4542, DB03671, NCGC00017309-03, NCGC00142481-02, NCGC00357149-01, AJ-47586, CC-26801, LS-52505, SMR001233370, ST056392, AB00513944, 6459-EP1441224A2, 6459-EP2269992A1, 6459-EP2272516A2, 6459-EP2277898A2, 6459-EP2298312A1, 6459-EP2316937A1, AB00513944_05, 5|A,20(22)-Cardenolide-3|A,12|A,14-triol, C-21538, 5beta,20(22)-Cardenolide-3beta,12beta,14-triol, J-010346, SR-01000841253-2, SR-01000841253-3, BRD-K18619710-001-03-7, I14-53600, 3beta,12beta,14-Trihydroxy-5beta,20(22)-cardenolide, (3b,5b,12b)-3,12,14-trihydroxycard-20(22)-enolide, Digoxigenin, European Pharmacopoeia (EP) Reference Standard, 3beta,12beta,14beta,21-Tetrahydroxy-20(22)-norcholenic acid lactone, Card-20(22)-enolide, 3,12,14-trihydroxy-, (3-beta,5-beta,12-beta)-, Card-20(22)-enolide, 3,12,14-trihydroxy-, (3-beta,5-beta,12-beta)- (9CI), 4-((1S,2S,5S,11S,15S,7R,10R,14R,16R)-5,11,16-trihydroxy-2,15-dimethyltetracycl o[8.7.0.0<2,7>.0<11,15>]heptadec-14-yl)-5-hydrofuran-2-one, 4-((3S,8R,9S,10S,12R,13S,14S,17R)-3,12,14-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)furan-2(5H)-one


ID: 2087

chemical graph of compound 2087



InChIKey: SIACJRVYIPXFKS-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1CN)S(=O)(=O)N.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 67313
synonyms found at PubChem are:
Mafenide hydrochloride, 138-37-4, 4-Aminomethylbenzenesulfonamide hydrochloride, Marfanil, 4-(Aminomethyl)benzenesulfonamide hydrochloride, Masudin, Morfanil, Homosulfamine, Homosulfamine hydrochloride, Emilene hydrochloride, Sulfamylon hydrochloride, Mafenide HCl, Sulfbenzamine hydrochloride, 4-Homosulfanilamide hydrochloride, Mesudin hydrochloride, Ambamide hydrochloride, Mesudrin hydrochloride, Neofamid hydrochloride, Homosulfanilamide hydrochloride, Maphenide hydrochloride, Mafenide (hydrochloride), p-Aminomethylphenylsulfonamide hydrochloride, UNII-3J751V0284, alpha-Amino-p-toluenesulfonamide hydrochloride, NSC 3527, p-(Aminomethyl)benzenesulfonamide hydrochloride, EINECS 205-325-3, p-(Aminomethyl)benzenesulfonamide monohydrochloride, AI3-16157, p-Toluenesulfonamide, alpha-amino-, hydrochloride, Benzenesulfonamide, 4-(aminomethyl)-, monohydrochloride, 3J751V0284, C7H10N2O2S.HCl, DSSTox_CID_25296, DSSTox_RID_80787, DSSTox_GSID_45296, p-Toluenesulfonamide, alpha-amino-, monohydrochloride, 4-(Aminomethyl)Benzene-1-Sulfonamide Hydrochloride, 4-(aminomethyl)benzenesulfonamide;hydrochloride, NCGC00016403-01, CAS-138-37-4, SR-01000003113, Prestwick_640, sulfamylonhydrochloride, a-amino-p-toluenesulfonamide hydrochloride, AC1Q3ETD, AC1L27AC, homosulfanilamidehydrochloride, MLS002222235, SCHEMBL425524, SPECTRUM1500372, WLN: ZSWR D1Z & GH, CHEMBL1593568, DTXSID6045296, CTK8B3767, HY-B0614B, NSC3527, MolPort-003-056-401, SIACJRVYIPXFKS-UHFFFAOYSA-N, HMS1568B13, HMS1920J11, p-Toluenesulfonamide, hydrochloride, Pharmakon1600-01500372, 4-sulfamoylbenzylamine hydrochloride, BCP03071, KS-000009JQ, NSC-3527, p-aminomethylbenzene sulfonamide hcl, 4-Aminomethylbenzenesulfonamide, HCl, Tox21_110423, ANW-43135, CCG-39706, MFCD00013005, NSC757093, AKOS008967290, p-AMINOMETHYLBENZENE-SULFONAMIDE, p-Toluenesulfonamide, monohydrochloride, Tox21_110423_1, 4-aminosulfonylbenzylamine hydrochloride, CS-4481, GS-4340, NSC-757093, RL01677, TRA0051493, NCGC00016403-06, NCGC00094711-01, NCGC00094711-02, NCGC00094711-03, NCGC00094711-04, 4CA-0795, AC-29745, AN-43815, BC200603, BR-32299, p-aminomethylphenylsulfonamidehydrochloride, SC-00739, SMR001307253, SY020868, p-AMINOMETHYLBENZENE-SULFONAMIDE HCl, 4-(aminosulfonyl)-benzylamine hydrochloride, AB0022213, KB-187386, KB-189311, LS-154100, p-aminomethylbenzenesulfonamide hydrochloride, ST2410990, TR-005078, 4-(AMINOMETHYL)BENZENESULFONAMIDE HCL, AM20060505, FT-0631805, p-aminomethyl-benzenesulfonamide hydrochloride, W3016, 4-(Aminomethyl)benzenesulfonamideHydrochloride, 4-aminomethyl-benzenesulfonamide hydrochloride, p-Aminomethyl benzene sulfonamide hydrochloride, alpha-amino-p-toluenesulfonamidmonohydrochloride, .alpha.-Amino-p-toluenesulfonamide hydrochloride, 4-(aminomethyl)benzene-sulfonamide hydrochloride, I01-2860, J-007128, J-521664, SR-01000003113-4, 4-(Aminomethyl)benzenesulfonamide hydrochloride (1:1), F0856-0073, Benzenesulfonamide, 4-(aminomethyl)-, monohydrochloride (9CI), 4-Aminomethylbenzenesulfonamide hydrochloride, analytical standard, >=95%, AKOS026750005, 4-(aminomethyl)benzenesulfonamide, chloride, SBB059851, AKOS023093332, MCULE-3873724782, ST51046115


ID: 2088

chemical graph of compound 2088



InChIKey: SIEYLFHKZGLBNX-UHFFFAOYSA-N
SMILES: CCCCN1CCCCC1C(=O)NC2=C(C=CC=C2C)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 64737
synonyms found at PubChem are:
Bupivacaine hydrochloride, Bupivacaine HCL, 14252-80-3, 18010-40-7, Vivacaine, 1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride, Marcain, Bupivacaine (hydrochloride), (+-)-Bupivacaine hydrochloride, Bupivacaine hydrochloride [JAN], EINECS 241-917-8, AH-2250, CHEBI:31322, 1-Butyl-N-(2,6-dimethylphenyl)-2-piperidinecarboxamide monohydrochloride, 2',6'-Pipecoloxylidide, 1-butyl-, hydrochloride, 2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-, monohydrochloride, 2',6'-Pipecoloxylidide, 1-butyl-, monohydrochloride, LAC-43, Win 11,318, Bupivacaine hydrochloride anhydrous, Bicain, Win 11318 HCl, SMR000058218, WIN-11318, MNarcaine hydrochloride, 14252-80-3 (HCl), 18010-40-7 (HCl), 73360-54-0 (HCl.H2O), Bupivacaine hydrochloride kit, LAC 43, SR-05000001874, levobupivacaine hydrochloride (anhydrous), SKY 0302, Prestwick_894, AH 2250, Marcaine hydrochloride preservation free, bupivacain hydrochloride, 2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-, monohydrochloride, monohydrate, Bupivacaine hydrochloride preservation free, AC1L21TT, bupivacaine monohydrochloride, SCHEMBL34374, MLS001361336, MLS002154259, SPECTRUM1503818, Bupicacain hydrochlorid-1-wasser, CHEMBL1200396, DTXSID0030877, CHEBI:77441, CTK8F8361, HY-B0405A, KS-00000XIC, AOB6341, Bupivacaine hydrochloride [USAN], MolPort-003-666-503, SIEYLFHKZGLBNX-UHFFFAOYSA-N, HMS1568N12, HMS1922I12, Pharmakon1600-01503818, Bupivacaine hydrochloride (Marcain), ACT04725, BCP22697, BCP22708, KS-00000M4Q, (+-)-1-Butyl-2',6'-pipecoloxylidide monohydrochloride, monohydrate, bupivacaine hydrochloride (anhydrous), CCG-39367, NSC119660, NSC758631, s2454, AKOS015889322, Marcain;Marcaine;Sensorcaine;Vivacaine, API0001784, BCP9000461, CS-2505, FD-0235, LS-2113, MCULE-5414144502, NSC-119660, NSC-758631, NCGC00095072-01, NCGC00095072-02, AK481431, AN-14283, AN-18756, H875, KB-48484, SC-24334, SC-94629, ST013772, AB2000569, AX8018312, LS-185059, B3925, FT-0082605, FT-0607564, FT-0623287, 52B803, K-4565, I01-1868, J-011502, Q-100158, SR-05000001874-3, 1-butyl-2-piperidylformo-2',6'-xylidide hydrochloride, 2-Piperidinecarboxamide,6-dimethylphenyl)-, hydrochloride, 1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium chloride, N-(2,6-dimethylphenyl)(1-butyl(2-piperidyl))carboxamide, chloride, rac-1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium chloride, rac-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride, 2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-, monohydrochlorde, monohydrate, 1-Butyl-N-(2,6-dimethylphenyl)-2-piperidinecarboxamide hydrochloride dl-1-n-Butylpiperidine-2-carboxylic acid 2,6-dimethylanilide hydrochloride, 15233-43-9, AKOS026749767, FT-0651247


ID: 2089

chemical graph of compound 2089



InChIKey: SIQPXVQCUCHWDI-UHFFFAOYSA-N
SMILES: CCCN1C2=C(C(=O)NC1=O)NC=N2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 1676
synonyms found at PubChem are:
ENPROFYLLINE, 3-Propylxanthine, 3-n-Propylxanthine, 41078-02-8, Enprofilina, Enprofyllinum, Nilyph, Oxeze, Enprofilina [INN-Spanish], Enprofyllinum [INN-Latin], Enprofylline [USAN:INN], 3,7-Dihydro-3-propyl-1H-purine-2,6-dione, D-4028, UNII-DT7DT5E518, 3-propyl-3,7-dihydro-1H-purine-2,6-dione, EINECS 255-201-8, 1H-Purine-2,6-dione, 3,7-dihydro-3-propyl-, Enprofylline (USAN/INN), 3-Propyl-3,7-dihydro-purine-2,6-dione, CHEMBL279898, DT7DT5E518, 3-propyl-7H-purine-2,6-dione, CHEBI:126237, 3-propyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, NCGC00015824-07, 3-Propyl-1H-purine-2,6(3H,7H)-dione, 3-Propyl-1H-purine-2,6(3H,9H)-dione, 1H-Purine-2,6-dione,3,9-dihydro-3-propyl-, P 5679, AC1L1BZI, AC1Q6LGE, Lopac-P-5679, D09AMZ, DSSTox_CID_25186, DSSTox_RID_80733, DSSTox_GSID_45186, Lopac0_000910, MLS000069700, SCHEMBL156402, 3-Propylxanthine (enprofylline), DTXSID9045186, SCHEMBL18029491, CTK4I4231, MolPort-020-915-589, SIQPXVQCUCHWDI-UHFFFAOYSA-N, HMS2234D09, HMS3262F22, HMS3369J09, ZINC403567, BCP14343, Tox21_110232, Tox21_500910, BDBM50001493, MFCD00043205, PDSP1_001019, PDSP1_001202, PDSP2_001003, PDSP2_001186, AKOS006271777, AKOS013464325, CCG-204992, DB00824, LP00910, VA10810, 3-propyl-1,9-dihydropurine-2,6-dione, NCGC00015824-01, NCGC00015824-02, NCGC00015824-03, NCGC00015824-04, NCGC00015824-05, NCGC00015824-06, NCGC00015824-08, NCGC00015824-09, NCGC00022716-03, NCGC00022716-04, NCGC00022716-05, NCGC00261595-01, AJ-22159, KB-50533, SMR000058496, ZB013298, CAS-41078-02-8, LS-127057, EU-0100910, FT-0630617, D 4028, D04006, L000242, SR-01000000173, 3-propyl-2,3,6,9-tetrahydro-1H-purine-2,6-dione, SR-01000000173-2, 3-Propyl-3,7-dihydro-purine-2,6-dione(enprofylline), Z1945707486


ID: 2090

chemical graph of compound 2090



InChIKey: SISOFUCTXZKSOQ-ZHACJKMWSA-N
SMILES: CC1=CC=CC(=N1)/C=C/C2=CC=CC=C2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5311432
synonyms found at PubChem are:
SIB 1893, SIB-1893, 2-methyl-6-(2-phenylethenyl)pyridine, 6266-99-5, SIB1893, 2-methyl-6-[(E)-2-phenylethenyl]pyridine, 7370-21-0, CHEMBL88612, MLS002607995, (E)-2-methyl-6-styrylpyridine, [E]-2-Methyl-6-[2-phenylethenyl]pyridine, (E)-2-Methyl-6-[2-phenylethenyl]pyridine, SR-01000076143, Lopac0_001171, Pyridine,2-methyl-6-(2-phenylethenyl)-, AC1NSKMI, AC1Q4VO3, GTPL1432, BDBM86715, CHEBI:93178, MolPort-003-959-634, HMS3263L03, 2-[(E)-Styryl]-6-methylpyridine, NSC36665, ZINC3941522, SIB 1893, >99%, solid, Tox21_501171, 2-Methyl-6-((E)-styryl)-pyridine, BDBM50084141, MFCD02262120, NSC-36665, PDSP1_001571, PDSP2_001555, AKOS006279967, CCG-205245, LP01171, CAS_5311432, NSC_5311432, NCGC00025046-02, NCGC00025046-03, NCGC00025046-04, NCGC00025046-05, NCGC00025046-06, NCGC00261856-01, 2-Methyl-6-styryl-pyridine(SIB-1893), BC600133, KB-60434, SMR000326914, (E)-2-Methyl-6-(2-phenylethyl)-pyridine, KB-231610, EU-0101171, S 9311, L000561, SR-01000076143-1, SR-01000076143-3, BRD-K67439147-001-01-7


ID: 2091

chemical graph of compound 2091



InChIKey: SIXVQHIRXMPXGZ-QHAWAJNXSA-N
SMILES: CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@]3(CC2)C)(C)C(=O)N)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 53320719
synonyms found at PubChem are:
Dehydroabietamide, CHEMBL1652147


ID: 2092

chemical graph of compound 2092



InChIKey: SJXJEAQVHBGSDL-BTQNPOSSSA-N
SMILES: CN1CCC2=C3[C@H]1CC4=C(C3=CC(=C2)O)C(=C(C=C4)O)O.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 11957531
synonyms found at PubChem are:
R(-)-2-Hydroxyapomorphine hydrobromide, R(-)-2,10,11-Trihydroxyaporphine hybrobromide, 77630-01-4, MLS000860019, SMR000326877, R(-)-2 10 11-TRIHYDROXYAPORPHINE, R(-)-2,10,11-Trihydroxyaporphine hydrobromide, EU-0100445, SCHEMBL4923294, CHEMBL1257041, DTXSID60474682, Tox21_500445, CCG-221749, LP00445, NCGC00261130-01, D-029, VU0254273-2, R()-2,10,11-Trihydroxyaporphine hydrobromide, SR-01000075371, SR-01000075371-1


ID: 2093

chemical graph of compound 2093



InChIKey: SJZHCCUPAKHVFK-VSXUVRPXSA-N
SMILES: C[C@H]1[C@H]2[C@H](CC3[C@@]2([C@@H](C(=O)C4C3CC[C@@H]5[C@@]4(CC[C@@H](C5)OC(=O)C)C)OC(=O)C)C)O[C@]16CCC(CO6)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6708609
synonyms found at PubChem are:
Spectrum_000791, SpecPlus_000220, Spectrum2_001169, Spectrum4_001430, Spectrum5_000260, KBioGR_001880, KBioSS_001271, DivK1c_006316, SPBio_001157, KBio1_001260, KBio2_001271, KBio2_003839, KBio2_006407, 11-KETOROCKOGENIN ACETATE


ID: 2094

chemical graph of compound 2094



InChIKey: SKAIDWFZCIKFIY-XYOKQWHBSA-N
SMILES: C=CCOc1ccccc1/C=C(\C#N)/c2c(c(n[nH]2)N)C#N

biological descriptors:

CFTR relevance: CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"Y Seo" "J Park" "AS Verkman" "W Namkung"


CID is 5760598
synonyms found at PubChem are:
AC1NXVU7, ZINC8565361, STK389064, AKOS000113050, BAS 00858152, SR-01000418461, SR-01000418461-1, 3-[2-(2-Allyloxy-phenyl)-1-cyano-vinyl]-5-amino-1H-pyrazole-4-carbonitrile, 3-amino-5-[(Z)-1-cyano-2-(2-prop-2-enoxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile, 5-amino-3-{(Z)-1-cyano-2-[2-(prop-2-en-1-yloxy)phenyl]ethenyl}-1H-pyrazole-4-carbonitrile


ID: 2095

chemical graph of compound 2095



InChIKey: SKAWDTAMLOJQNK-UHFFFAOYSA-N
SMILES: CCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2004
synonyms found at PubChem are:
ethyl N-acetyltyrosinate, acetyltyrosine ethyl ester, ACETYL TYROSINE ETHYL ESTER, Ethyl acetyltyrosine, Ethyl acetyltyrosinate, Acetyl-L-tyrosine ethyl ester, N-Acetyl-L-tyrosyl ethyl ester, ethyl 2-acetamido-3-(4-hydroxyphenyl)propanoate, N-Acetyltyrosine ethyl ester, Ethyl (2S)-2-(acetylamino)-3-(4-hydroxyphenyl)propanoate, NSC 64725, NSC 87506, Spectrum_000396, AC1L1CPO, Spectrum2_001345, Spectrum3_001394, Spectrum4_000107, Spectrum5_001342, N-acetyl-l-tyr ethyl ester, NCIOpen2_003135, BSPBio_003008, CBDivE_014491, KBioGR_000434, KBioSS_000876, DivK1c_000250, SCHEMBL468858, SPECTRUM1500695, SPBio_001529, ARONIS001784, CHEMBL1354672, CTK9A5467, HMS500M12, KBio1_000250, KBio2_000876, KBio2_003444, KBio2_006012, KBio3_002228, SKAWDTAMLOJQNK-UHFFFAOYSA-, CHEBI:110178, MolPort-001-495-443, NINDS_000250, SKAWDTAMLOJQNK-UHFFFAOYSA-N, HMS1921E08, AC1Q3239, AC1Q6405, NSC64725, NSC87506, ACETYL-L-TYROSINE,ETHYL ESTER, CCG-39283, NSC-64725, NSC-87506, STK048746, AKOS000491736, AKOS016352351, MCULE-6893452025, IDI1_000250, KS-00003V63, Tyrosine, N-acetyl-, ethyl ester, L-, NCGC00094836-01, NCGC00094836-02, NCGC00094836-03, ST45038599, BRD-A55063801-001-02-6, Ethyl 2-(acetylamino)-3-(4-hydroxyphenyl)propanoate, Z57205547, 2-(Acetylamino)-3-(4-hydroxyphenyl)propanoic acid ethyl ester, 30697-69-9, InChI=1/C13H17NO4/c1-3-18-13(17)12(14-9(2)15)8-10-4-6-11(16)7-5-10/h4-7,12,16H,3,8H2,1-2H3,(H,14,15)


ID: 2096

chemical graph of compound 2096



InChIKey: SKCUFZLDTAYNBZ-UHFFFAOYSA-N
SMILES: CC1=CC(=C(C2=C1C(=O)OC3=C(O2)C4=C(C(=C3C)O)C(=O)OC4O)C=O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 73677
synonyms found at PubChem are:
STICTIC ACID, 549-06-4, NSC87511, NSC-87511, CHEMBL173530, 1,3-Dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro(4,5-b)(1,4)benzodioxepin-11-carboxaldehyde, 20426-13-5, 7H-Isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde,1,3-dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-, 7H-Isobenzofuro(4,5-b)(1,4)benzodioxepin-11-carboxaldehyde, 1,3-dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-, 7H-Isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde, 1,3-dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-, C19H14O9, NSC 87511, Spectrum_000600, Spectrum2_000307, Spectrum3_001185, Spectrum4_001446, Spectrum5_000031, Stictic acid (StA), 1, AC1L2KA7, AC1Q6O4T, BSPBio_002829, KBioGR_001931, KBioSS_001080, SPECTRUM300006, cid_73677, MLS001049107, REGID_for_CID_73677, SPBio_000274, SCHEMBL13495711, CHEBI:93839, CTK5A2753, KBio2_001080, KBio2_003648, KBio2_006216, KBio3_002329, MolPort-002-513-899, SKCUFZLDTAYNBZ-UHFFFAOYSA-N, HMS2271H11, BDBM50056922, CCG-38584, AKOS027326813, MCULE-1616140952, SDCCGMLS-0066543.P001, NCGC00095566-01, NCGC00095566-02, NCGC00095566-03, NCI60_041935, SMR000386939, NCGC00095566-02!STICTIC ACID, dihydroxy-methoxy-dimethyl-dioxo-[?]carbaldehyde, SR-01000758942, SR-01000758942-2, BRD-A29578214-001-02-7, BRD-A29578214-001-08-4, 1,4-Dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-1,3-dihydro-7H-2,6,12-trioxabenzo[5,6]cyclohepta[1,2-E]indene-11-carbaldehyde #, 1,4-Dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-1,3-dihydro-7H-benzo[e]furo[3'',4'':3,4]benzo[b][1,4]dioxepine-11-carbaldehyde, Isophthalaldehydic acid,.alpha.2,4,6-tetrahydroxy-2,5-xylyl)oxy]-4-methoxy-6-methyl-, .gamma.-lactone, .epsilon.-lactone


ID: 2097

chemical graph of compound 2097



InChIKey: SKPLBLUECSEIFO-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1OCC(COC(=O)N)O)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2724
synonyms found at PubChem are:
CHLORPHENESIN CARBAMATE, Maolate, 886-74-8, Rinlaxer, 3-(4-Chlorophenoxy)-2-hydroxypropyl carbamate, Chlorphensin carbamate, Kolpicortin-sine, 3-(p-Chlorophenoxy)-2-hydroxypropyl carbamate, 3-(p-Chlorophenoxy)-1,2-propanediol 1-carbamate, 3-(4-Chlorophenoxy)-1,2-propanediol-1-carbamate, NSC 82943, Carbamic acid, 3-(p-chlorophenoxy)-2-hydroxypropyl ester, 3-(p-Chlorophenoxy)-1,2-propanediol-1-carbamate, U 19646, U-19,646, 1,2-Propanediol, 3-(p-chlorophenoxy)-, 1-carbamate, HSDB 3031, 1,2-Propanediol, 3-(4-chlorophenoxy)-, 1-carbamate, Chlorphenesin carbamate [USAN:JAN], EINECS 212-954-7, BRN 1978575, CHEBI:3643, SKPLBLUECSEIFO-UHFFFAOYSA-N, NSC82943, carbamic acid 3-(p-chlorophenoxy)-2-hydroxypropyl ester, (3-p-Chlorophenoxy)-2-hydroxypropylcarbamate, C10H12ClNO4, [3-(4-chlorophenoxy)-2-hydroxypropyl] carbamate, 1,2-propanediol-3-(p-chlorophenoxy)-1-carbamate, 3-[4-Chlorophenoxy]-1,2-propanediol-1-carbamate, 1,2-Propanediol,3-(4-chlorophenoxy)-, 1-carbamate, W-100393, NCGC00016548-01, CAS-886-74-8, Prestwick_882, Maolate (TN), AC1L1EBN, Prestwick0_000234, Prestwick1_000234, Prestwick2_000234, Prestwick3_000234, DSSTox_CID_2803, D0VB0U, AC1Q3ON3, WLN: ZVO1YQ1OR DG, DSSTox_RID_76735, DSSTox_GSID_22803, SCHEMBL34492, BSPBio_000307, MLS002154243, SPBio_002228, BPBio1_000339, CHEMBL607710, DTXSID5022803, CTK5G1170, HMS1568P09, HMS2095P09, HMS2232O23, HMS3371A08, HMS3712P09, Tox21_110487, NSC-82943, Chlorphenesin carbamate (JP17/USAN), CCG-220234, VZ31569, 1, 3-(p-chlorophenoxy)-, 1-carbamate, NCGC00179607-01, NCGC00179607-03, 1, 3-(4-chlorophenoxy)-, 1-carbamate, CC-25726, LS-49160, SMR001233511, FT-0602972, C07930, D00770, [3-(4-chlorophenoxy)-2-hydroxy-propyl] carbamate, C-14937, SR-01000841824, U-19646, 3-[(4-chlorophenyl)oxy]-2-hydroxypropyl carbamate, SR-01000841824-2, BRD-A39230911-001-03-7, 1,2-Propanediol, 3-(p-chlorophenoxy)-, 1-carbamate (8CI)


ID: 2098

chemical graph of compound 2098



InChIKey: SKVLYVHULOWXTD-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1NC(=O)CCC(=O)O)S(=O)(=O)NC2=NC=CS2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5315
synonyms found at PubChem are:
succinylsulfathiazole, 116-43-8, Cremosuxidine, Colistatin, Sulfasuccidine, Sulfasuccinil, Sulfasuxidine, Sulfadigesin, Succinylsulphathiazole, Sulfasuccithiazole, Sulfasuccidin, Sulfenterone, Kaoxidin, Kaoxidine, Rolsul, Thiacyl, 4'-(2-Thiazolylsulfamoyl)succinanilic acid, Succinilsulfatiazol, Succinilsolfatiazolo, Succinylsulfathiazol, Succinylsulfathiazolum, p-2-Thiazolylsulfamylsuccinanilic acid, UNII-RSS8647O4S, Butanoic acid, 4-oxo-4-[[4-[(2-thiazolylamino)sulfonyl]phenyl]amino]-, NSC 14193, NSC 163939, Anhydrous Succinylsulfathiazole, 2-(N(sup4)-Succinylsulfanilamido)thiazole, CHEBI:9309, RSS8647O4S, Succinanilic acid, 4'-(2-thiazolylsulfamoyl)-, SKVLYVHULOWXTD-UHFFFAOYSA-N, Succinilsolfatiazolo [DCIT], NSC14193, 2-(N4-Succinylsulfanilamido)thiazole, NSC163939, 4-oxo-4-[4-(thiazol-2-ylsulfamoyl)anilino]butanoic acid, NCGC00016367-01, C13H13N3O5S2, CAS-116-43-8, Succinilsulfatiazol [INN-Spanish], Succinylsulfathiazol [INN-French], Succinylsulfathiazolum [INN-Latin], EINECS 204-141-0, DSSTox_CID_25281, DSSTox_RID_80782, BRN 0349989, DSSTox_GSID_45281, 4'-(1,3-Thiazol-2-ylsulphamoyl)succinanilic acid, AI3-26816, 4-oxo-4-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]butanoic acid, Succinylsulfathiazole (INN), 4-oxo-4-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)butanoic acid, Butanoic acid, 4-oxo-4-((4-((2-thiazolylamino)sulfonyl)phenyl)amino)-, N4-Succinyl-N-(2-thiazolyl)sulfanilamide, Succinyl sulfathiazole, SR-01000000176, 4-(Succinylamino)-N-(2-thiazolyl)benzenesulfonamide, succinylsulfathiazole[inn], Prestwick_1016, Succinylsulfathiazole [USP:INN:BAN], N-succinylsulfathiazole, Spectrum_001389, Maybridge1_006038, Prestwick0_000702, Prestwick1_000702, Prestwick2_000702, Prestwick3_000702, Spectrum2_001946, Spectrum3_001488, Spectrum4_000045, Tharap cat: antimicrobial, ACMC-209u5s, AC1L1K2W, Oprea1_335927, REGID_for_CID_5315, BSPBio_000883, BSPBio_003075, KBioGR_000509, KBioSS_001869, 4-27-00-04637 (Beilstein Handbook Reference), KSC492Q7H, MLS000069715, DivK1c_001028, SCHEMBL151873, SPECTRUM1502025, SPBio_002011, SPBio_002804, Succinylsulfathiazole, >=98%, AC1Q6W23, BPBio1_000973, CHEMBL1484857, DTXSID7045281, CTK3J2873, HMS503M17, HMS558K10, KBio1_001028, KBio2_001869, KBio2_004437, KBio2_007005, KBio3_002575, CCG-439, MolPort-000-421-568, NINDS_001028, HMS1570M05, HMS1921F06, HMS2092N21, HMS2097M05, HMS2230P18, HMS3373O12, HMS3714M05, Pharmakon1600-01502025, AC1Q7561, HY-B0921, ZINC1532343, Tox21_110400, ANW-43358, GA4716, MFCD00022437, NSC-14193, NSC758161, s4585, STK079059, Succinylsulfathiazole, ~95% (TLC), AKOS002161889, Tox21_110400_1, API0010062, MCULE-7766194789, NSC-163939, NSC-758161, RTR-031131, IDI1_001028, NCGC00016367-02, NCGC00016367-03, NCGC00016367-04, NCGC00016367-05, NCGC00016367-06, NCGC00016367-08, NCGC00022723-03, NCGC00022723-04, AN-22759, AS-15960, R534, SC-57927, SMR000058172, SBI-0051704.P002, TR-031131, 4\'-(2-Thiazolylsulfamoyl)succinanilic acid, AB00052259, EU-0083314, FT-0631665, S0581, S0991, ST50036309, C11745, D07060, AB00052259_13, 116S438, N4-Succinyl-N-(2-thiazolyl)sulfanilamide hydrate, J-003439, SR-01000000176-2, SR-01000000176-3, SR-01000000176-4, BRD-K01950558-001-05-5, BRD-K01950558-001-09-7, I04-12387, F0856-0033, 4-(Succinylamino)-N-(2-thiazolyl)benzenesulfonamide hydrate, 4-oxo-4-(4-(N-thiazol-2-ylsulfamoyl)phenylamino)butanoic acid, 4-oxo-4-((4-((2-thiazolylamino)sulfonyl)phenyl)amino)butanoic acid, 4-Oxo-4-[[4-[(2-thiazolylamino)sulfonyl]phenyl]amio]-butanoic acid, 4-oxo-4-{[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino}butanoic acid, 3-(N-{4-[(1,3-thiazol-2-ylamino)sulfonyl]phenyl}carbamoyl)propanoic acid, 4-Oxo-4-(4-[(1,3-thiazol-2-ylamino)sulfonyl]anilino)butanoic acid #, 4-Oxo-4-[[4-(thiazol-2-ylsulfamoyl)phenyl]amino]butanoic acid monohydrate, Butanoic acid, 4-oxo-4-((4-((2-thiazolylamino)sulfonyl)phenyl)amino)- (9CI), 1391-00-0


ID: 2099

chemical graph of compound 2099



InChIKey: SKVPTPMWXJSBTF-UHFFFAOYSA-N
SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 98889
synonyms found at PubChem are:
4-Hydroxyantipyrine, 1672-63-5, Antipyrine, 4-hydroxy, SKVPTPMWXJSBTF-UHFFFAOYSA-N, 4-Hydroxy-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one, 4-hydroxy-1,5-dimethyl-2-phenyl-1,2-dihydro-3h-pyrazol-3-one, 4-hydroxy-1,5-dimethyl-2-phenylpyrazol-3-one, 4-Hydroxyantipyrene, Prestwick_270, NSC 174055, AC1Q6ISQ, Prestwick0_000030, Prestwick1_000030, Prestwick2_000030, Prestwick3_000030, 4-Hydroxyantipyrine, 99%, AC1L40HV, UNII-DPZ41NV570, BSPBio_000099, MLS002154180, SCHEMBL151171, SPBio_002020, BPBio1_000109, DPZ41NV570, CHEMBL1526434, CHEBI:94641, DTXSID70168242, MolPort-003-925-870, HMS1568E21, HMS2095E21, HMS2230K12, HMS3370O19, HMS3712E21, ZINC119268, NSC174055, STL454169, AKOS022181399, CCG-214538, NSC-174055, 4-Hydroxyantipyrine, analytical standard, NCGC00016592-01, NCGC00016592-02, NCGC00179659-01, AJ-11559, CC-19520, CS-15446, KB-39146, SMR001233473, CAS-1672-63-5, CS-0020302, FT-0633751, 4-hydroxy-1,5-dimethyl-2-phenyl-3-pyrazolone, 1,5-dimethyl-4-oxidanyl-2-phenyl-pyrazol-3-one, A811196, C-29865, SR-01000841217, J-010349, SR-01000841217-2, BRD-K49759007-001-03-6, BRD-K49759007-001-06-9, 3H-Pyrazol-3-one,2-dihydro-4-hydroxy-1,5-dimethyl-2-phenyl-, 1,2-Dihydro-4-hydroxy-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one, 3H-Pyrazol-3-one, 1,2-dihydro-4-hydroxy-1,5-dimethyl-2-phenyl- (9CI)


ID: 2100

chemical graph of compound 2100



InChIKey: SKZKKFZAGNVIMN-UHFFFAOYSA-N
SMILES: C1=CC=C(C(=C1)C(=O)N)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5147
synonyms found at PubChem are:
salicylamide, 2-Hydroxybenzamide, 65-45-2, o-Hydroxybenzamide, Benzamide, 2-hydroxy-, Salicylic acid amide, 2-Carbamoylphenol, Flarpirina, Morsarinas, Algamon, Algiamida, Allevin, Amidosal, Andasol, Dolomide, Dropsprin, Eggosalil, Novecyl, Panithal, Raspberin, Salamid, Salamide, Saliamid, Saliamin, Salicim, Salipur, Salizell, Salymid, Serramida, Urtosal, Acket, Anamid, Oramid, Salrin, 2-Carboxamidophenol, Afko-Sal, Amid-Sal, Benzamide, o-hydroxy-, Salicilamida, Salicilamide, Salicylamidum, Salizell (VAN), Benesal (VAN), Salicilamide [DCIT], Salicilamide [Italian], Amid kyseliny salicylove, UNII-EM8BM710ZC, NSC 3115, Salicylamidum [INN-Latin], OHB, Salicilamida [INN-Spanish], H.P. 34, SR 4326, CCRIS 6045, HSDB 227, Amid kyseliny salicylove [Czech], Benzoic acid, 2-hydroxy-, amide, EINECS 200-609-3, BRN 0742439, EM8BM710ZC, CHEMBL27577, AI3-03454, MLS000069486, CHEBI:32114, SKZKKFZAGNVIMN-UHFFFAOYSA-N, NCGC00091414-02, SMR000046394, DSSTox_CID_1726, DSSTox_RID_76295, DSSTox_GSID_21726, CAS-65-45-2, Salicylamid, Samid, Salicylamide [INN:BAN:JAN], hydroxy benzamide, Saliclamide,(S), dihydroxybenzalamine, 2-oxidanylbenzamide, Salicylamide [USP:INN:BAN:JAN], Salicylamide (TN), 2-Hydroxy-benzamide, Salicylamide, 99%, PubChem10992, Spectrum_000946, ACMC-209nqv, AC1L1JPI, Opera_ID_1684, Spectrum2_001312, Spectrum3_000564, Spectrum4_000499, Spectrum5_001032, WLN: ZVR BQ, EC 200-609-3, AC1Q4Z8X, NCIOpen2_001127, Oprea1_069894, SCHEMBL21646, BSPBio_001948, KBioGR_001017, KBioSS_001426, 4-10-00-00169 (Beilstein Handbook Reference), KSC353S5B, DivK1c_000858, SPECTRUM1500532, Salicylamide (JAN/USP/INN), SPBio_001403, ZINC2055, Benzamide, 2-hydroxy- (9CI), DTXSID3021726, CTK2F3950, HMS502K20, KBio1_000858, KBio2_001426, KBio2_003994, KBio2_006562, KBio3_001448, NSC3115, MolPort-001-641-072, NINDS_000858, HMS1920P14, HMS2092G15, HMS2232E07, Pharmakon1600-01500532, component of Tolagesic (Salt/Mix), HY-B0811, Hydrochlorothiazide Related Compound, KS-00000H1J, NSC-3115, Tox21_111129, Tox21_201944, Tox21_302801, ANW-35045, BBL016007, BDBM50056900, CCG-39250, MFCD00007978, NSC757318, SBB058584, STK301812, AKOS000120983, Tox21_111129_1, CS-7630, DB08797, LS-1556, MCULE-5482995635, NSC-757318, RP20335, RTR-022279, TRA0035157, IDI1_000858, NCGC00091414-01, NCGC00091414-03, NCGC00091414-04, NCGC00091414-05, NCGC00091414-07, NCGC00256376-01, NCGC00259493-01, 36205-82-0 (mono-hydrochloride salt), AJ-08127, AN-23746, BR-81394, CJ-00076, DS-16216, KB-24513, Salicylamide, puriss., >=99.0% (T), SC-46863, SBI-0051509.P003, AB1004776, ST2410041, TR-022279, EU-0000058, FT-0659360, S0006, ST45061688, D01811, M-6078, 91096-EP2380872A1, AB00052089_12, A835120, AH-034/32461056, SR-01000721923, BENZOIC ACID,2-HYDROXY,AMIDE SALICYLAMIDE, I01-5217, J-509663, SR-01000721923-2, BRD-K81130846-001-02-6, BRD-K81130846-001-12-5, Z68590124, 2,4-Cyclohexadien-1-one, 6-(aminohydroxymethylene)- (9CI), Salicylamide, United States Pharmacopeia (USP) Reference Standard, 2-HYDROXYBENZAMIDE (SEE ALSO:N-HYDROXYBENZAMIDE (CAS 495-18-1)), InChI=1/C7H7NO2/c8-7(10)5-3-1-2-4-6(5)9/h1-4,9H,(H2,8,10, Salicylamide, Pharmaceutical Secondary Standard; Certified Reference Material, 287492-04-0


ID: 2101

chemical graph of compound 2101



InChIKey: SLAVHURDNZJSIH-UHFFFAOYSA-N
SMILES: CC1=C2C(=CC(=C1Cl)O)OC3(C2=O)C(=C(C(=CC3=O)O)Cl)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3334572
synonyms found at PubChem are:
Griseofulvin Analog A, KBio2_007384, Spectrum_001768, SpecPlus_000114, AC1MNWM2, Spectrum3_001049, Spectrum4_001189, BSPBio_002578, KBioGR_001857, KBioSS_002249, DivK1c_006210, KBio1_001154, KBio2_002248, KBio2_004816, KBio3_001798, NCGC00178593-01, 2',5-dichloro-5',6-dihydroxy-3',4-dimethyl-spiro[benzofuran-2,4'-cyclohexa-2,5-diene]-1',3-dione, 4',5-dichloro-3',6-dihydroxy-4,5'-dimethylspiro[1-benzofuran-2,6'-cyclohexa-2,4-diene]-1',3-dione


ID: 2102

chemical graph of compound 2102



InChIKey: SLAYUXIURFNXPG-CRAIPNDOSA-N
SMILES: C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3CN)C(=O)O)CSC4=NN=NN4CC(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 43507
synonyms found at PubChem are:
CEFORANIDE, Precef, 60925-61-3, Ceforanido, Ceforanidum, Ceforanidum [INN-Latin], Ceforanido [INN-Spanish], Radacef, BL-S786, bl s786, BL-S 786, Ceforanide [USAN:INN:BAN], UNII-8M1YF8951V, Precef (TN), C20H21N7O6S2, Ceforanide (USP/INN), CHEBI:3495, (6R,7R)-7-[[2-[2-(aminomethyl)phenyl]acetyl]amino]-3-[[1-(carboxymethyl)tetrazol-5-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 8M1YF8951V, (6R,7R)-7-(2-(alpha-Amino-o-tolyl)acetamido)-3-(((1-(carboxymethyl)-1H-tetrazol-5-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(o-(Aminomethyl)phenylacetamido)-3-(((1-(carboxymethyl)-1H-tetrazol-5-yl)thio)methyl)-3-cephem-4-carboxylic acid, Ceforanide sodium, (6R-trans)-7-(((2-(Aminomethyl)phenyl)acetyl)amino)-3-(((1-(carboxymethyl)-1H-tetrazol-5-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, (6R,7R)-7-({[2-(aminomethyl)phenyl]acetyl}amino)-3-({[1-(carboxymethyl)-1H-tetrazol-5-yl]sulfanyl}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-({[2-(aminomethyl)phenyl]acetyl}amino)-3-({[1-(carboxymethyl)-1H-tetrazol-5-yl]thio}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-{2-[2-(aminomethyl)phenyl]acetamido}-3-({[1-(carboxymethyl)-1H-1,2,3,4-tetrazol-5-yl]sulfanyl}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-(aminomethyl)phenyl)acetyl)amino)-3-(((1-(carboxymethyl)-1H-tetrazol-5-yl)thio)methyl)-8-oxo-, (6R-trans)-, 7-[O-(aminomethyl)phenylacetamido]-3-[[[1-(carboxymethyl)-1H-tetrazol-5-yl]thio]methyl]-3-cephem-4-carboxylic acid, 7beta-[2-(aminomethyl)phenyl]acetamido-3-{[1-(carboxymethyl)-1H-tetrazol-5-yl]sulfanyl}methyl-3,4-didehydrocepham-4-carboxylic acid, SR-01000872614, Ceforanide [USAN:USP:INN:BAN], NCGC00016897-01, CAS-60925-61-3, AC1Q6LON, ceforanide monosodium salt, Prestwick0_000470, Prestwick1_000470, Prestwick2_000470, Prestwick3_000470, DSSTox_CID_2760, D06OUL, AC1L2A0U, DSSTox_RID_76719, DSSTox_GSID_22760, BSPBio_000580, SCHEMBL122072, SPBio_002519, BL-S786R, BPBio1_000638, CHEMBL1201046, DTXSID1022760, MolPort-006-167-662, HMS1569M22, HMS2096M22, HMS3713M22, ZINC3830434, Tox21_110670, AKOS027427040, API0009042, CCG-220470, DB00923, AN-39394, AS-15783, Q766, SC-89759, LS-176135, AB00513845, FT-0698679, C06884, D00259, 925C613, SR-01000872614-2, SR-01000872614-3, BRD-K37848908-001-03-1


ID: 2103

chemical graph of compound 2103



InChIKey: SLGMBDZRONTSMC-UHFFFAOYSA-M
SMILES: C1=CC=C2C=[N+](C=CC2=C1)CCCO.[Cl-]

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MJ Kurth" "LJ Galietta" "MJ Haddadin" "MF Springsteel" "MH Nantz" "K By" "AS Verkman" "M Eda" "EJ Niedzinski"


CID is 10822985


ID: 2104

chemical graph of compound 2104



InChIKey: SLSIBLKBHNKZTB-UHFFFAOYSA-N
SMILES: COC1=C(C2=C(C=C1)C(=C3C=COC3=N2)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6760
synonyms found at PubChem are:
Skimmianine, Skimmianin, 83-95-4, Chloroxylonine, 4,7,8-Trimethoxyfuro[2,3-b]quinoline, Skimmiamine, .beta.-Fagarine, b-fagarine, beta-Fagarine, Furo[2,3-b]quinoline, 4,7,8-trimethoxy-, UNII-4E1KLC380B, CCRIS 1585, NSC 217986, BRN 0028904, 4E1KLC380B, CHEBI:9172, 4,7,8-trimethoxyfurano[2,3-b]quinoline, FURO(2,3-b)QUINOLINE, 4,7,8-TRIMETHOXY-, Furo[2, 4,7,8-trimethoxy-, Prestwick_184, AC1Q4FEY, Prestwick0_000668, Prestwick1_000668, Prestwick2_000668, Prestwick3_000668, CBMicro_015540, AC1L1N8S, Oprea1_449938, Oprea1_598261, BSPBio_000735, MLS001049147, CHEMBL21396, SCHEMBL893654, SPBio_002656, BPBio1_000809, MEGxp0_000036, ZINC35525, DTXSID90232116, MolPort-000-742-994, SLSIBLKBHNKZTB-UHFFFAOYSA-N, HMS1570E17, HMS2097E17, HMS2268L06, NSC94654, TNP00202, BBL028481, NSC-94654, NSC217986, STL372641, AKOS004111157, CCG-208371, MCULE-8440641154, NSC-217986, CAS-83-95-4, NCGC00016333-01, NCGC00016333-02, NCGC00016333-03, NCGC00016333-05, NCGC00142348-01, 4CN-0525, LS-70939, NS-03981, SMR000386971, ST005173, BIM-0015492.P001, 4,7,8-Trimethoxyfuro[2,3-b]quinoline #, Furo[2,3-b]quinoline,4,7,8-trimethoxy-, FT-0699040, A10746, C10740, SR-01000739093, SR-01000739093-3, BRD-K25741894-001-03-8, 5255-76-5, InChI=1/C14H13NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7H,1-3H


ID: 2105

chemical graph of compound 2105



InChIKey: SLVOKEOPLJCHCQ-OUKQBFOZSA-N
SMILES: CCCCCCCC/C=C/CCCCCCCCOP(=O)([O-])OCC[N+](C)(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 14856193
synonyms found at PubChem are:
ELAIDYLPHOSPHOCHOLINE, CHEBI:75487, 1-elaidylphosphocholine, SPECTRUM1505337, CHEMBL387559, SCHEMBL10415339, SCHEMBL18952927, (E)-octadec-9-enylphosphocholine, trans-9-Octadecenyl Phosphocholine, CCG-40030, (9E)-octadec-9-en-1-ylphosphocholine, NCGC00095351-01, NCGC00095351-02, J-006955, (9E)-octadec-9-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate, 137052-40-5


ID: 2106

chemical graph of compound 2106



InChIKey: SLXKOJJOQWFEFD-UHFFFAOYSA-N
SMILES: C(CCC(=O)O)CCN

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 564
synonyms found at PubChem are:
6-aminohexanoic acid, 6-Aminocaproic acid, aminocaproic acid, 60-32-2, amicar, Epsikapron, Capramol, Caprocid, Epsamon, EACA, Acepramin, Caprolisin, Epsicapron, Hemocaprol, Respramin, Amikar, Hexanoic acid, 6-amino-, Epsilcapramin, Acepramine, Aminokapron, Caplamin, Capracid, Afibrin, Atsemin, EPSILON-AMINOCAPROIC ACID, Hemopar, Ipsilon, Hepin, Epsilon S, Aminocaproic, Capralense, epsilon-Leucine, EACS, epsilcapramine, epsilon-Norleucine, 6-Amino-n-hexanoic acid, omega-Aminocaproic acid, epsilon-Aminohexanoic acid, 6-amino-hexanoic acid, Capranol, omega-Aminohexanoic acid, Eaca kabi, Acido aminocaproico, Acidum aminocaproicum, epsilon-Amino-n-hexanoic acid, Epsilon-aminocapronzuur, Aminohexanoic acid, Epsilon-Aminocapronsaeure, Acide aminocaproique, CY 116, Caproamin, 6-aminohexanoate, Acide aminocaproique [French], Acidum aminocaproicum [Latin], CY-116, epsilon Aminocaproic Acid, e-Aminocaproic acid, epsilon-aminocaproate, Amicar (TN), 177 J.D., CL 10304, Acido aminocaproico [DCIT,Spanish], epsilon-Amino-n-caproic acid, NSC-26154, Kyselina omega-aminokapronova [Czech], Aminocaproate, Epsicaprom, 6-amino-n-caproic acid, ACS, epsilon-Ahx, acide aminocaproque, Kyselina omega-aminokapronova, JD 177, NSC 26154, HEXANOIC ACID,6-AMINO, Aminocaproic Acid In Plastic Container, .epsilon.-Norleucine, CCRIS 7706, 6-amino caproic acid, epsilon-Aminocaproic acid (JAN), HSDB 3005, CY116, UNII-U6F3787206, Acide aminocaproique [INN-French], Acido aminocaproico [INN-Spanish], Acidum aminocaproicum [INN-Latin], Aminocaproic acid (USP), Aminocaproic acid [USAN:BAN:INN], Aminocaproic acid [USAN:INN:BAN], EINECS 200-469-3, .omega.-Aminocaproic acid, 6-amino-n-caproate, 1319-82-0, .omega.-Aminohexanoic acid, NSC 400230, .epsilon.-Aminocaproic acid, 177 J.D, BRN 0906872, .epsilon.-Aminohexanoic acid, Aminocaproic acid (USP/INN), AI3-14512, CHEBI:16586, SLXKOJJOQWFEFD-UHFFFAOYSA-N, .epsilon. S, .epsilon.-Leucine, NSC26154, NSC400230, CAS-60-32-2, NCGC00015092-02, CL-10304, DSSTox_CID_70, U6F3787206, WLN: Z5VQ, A 7824, DSSTox_RID_75347, DSSTox_GSID_20070, e-amino-n-caproic acid, S04-0132, 6-Aminohexanoicacid, SMR000059162, 6 Aminocaproic Acid, 6 Aminohexanoic Acid, SR-01000075688, Acikaprin, amino caproic, Aminocapronsaure, e-Aminocaproate, w-Aminocaproate, e-Norleucine, e-Aminohexanoate, w-Aminohexanoate, 6-Aminocaproate, e-Leucine, epsilon-S, 1cea, 3kiv, Aminocaproic Acids, 6-amino-Hexanoate, 6Aminocaproic acid, omega-Aminocaproate, Amino Caproic Acid, Fullevir (TN), trifluoroacctic acid, H-epsilon-Acp-OH, omega-Aminohexanoate, w-Aminocaproic acid, e-Amino-n-hexanoate, e-Aminohexanoic acid, w-Aminohexanoic acid, 6-Amino-n-hexanoate, epsilon-Aminohexanoate, Epsillon-Aminocaproate, H-EAhx-OH, Acid, 6-Aminocaproic, H-Acp-OH, Acid, 6-Aminohexanoic, Aminocaproic acid [USAN:USP:INN:BAN], Spectrum_000038, ACMC-1AXZE, e-Amino-n-hexanoic acid, e-Aminocaproic acid USP, epsilon-Amino-n-hexanoate, H-6-Ahx-OH, Prestwick0_000960, Prestwick1_000960, Prestwick2_000960, Prestwick3_000960, Spectrum2_000131, Spectrum4_000143, Spectrum5_000780, Lopac-A-7824, Epsillon-Aminocaproic acid, epsilon-amino caproic acid, Acid, epsilon-Aminocaproic, bmse000394, D05QNF, D0FD0H, D0LU5G, Aminocaproic acid (Amicar), AC1L19IP, AC1Q54EY, 6-Aminocaproic acid; EACA, 6-ACA, CHEMBL1046, Lopac0_000082, SCHEMBL15293, BSPBio_000960, CBDivE_004370, KBioGR_000586, KBioSS_000398, (6-)|A-?Aminocaproic acid, epsilon-Aminocaproic acid USP, KSC238G9H, MLS001335991, MLS002695931, BIDD:GT0162, DivK1c_000551, NH2-(CH2)5-COOH, SPECTRUM1500114, SPBio_000202, SPBio_003109, BPBio1_001056, GTPL6574, .epsilon.-Amino-n-caproic acid, DTXSID0020070, .epsilon.-Amino-n-hexanoic acid, CHEBI:79212, CTK1D8393, HMS501L13, KBio1_000551, KBio2_000398, KBio2_002966, KBio2_005534, MolPort-001-779-881, NINDS_000551, HMS1570P22, HMS1920C07, HMS2091I07, HMS2097P22, HMS2231F21, HMS3260A06, HMS3373F09, HMS3655M17, HMS3714P22, Pharmakon1600-01500114, ALBB-022460, BCP24729, BCP27495, EBD17973, HY-B0236, KS-00000AE0, ZINC1529425, Tox21_110081, Tox21_500082, AC-035, ANW-33472, BBL007716, BDBM50357211, CCG-38935, LMFA01100035, MFCD00008238, NSC212532, NSC755867, s1671, SBB015068, STK246894, 6-Aminohexanoic acid, 99% 100g, AKOS000118734, Tox21_110081_1, AM82438, CS-2204, DB00513, KS-5276, LP00082, LS-7191, MCULE-3640363033, NE10566, NSC-212532, NSC-400230, NSC-755867, RP19960, RTR-020850, TRA0081138, IDI1_000551, pound 6- pound(c)|A-Aminocaproic acid, 6-Aminocaproic acid, BioUltra, >=99%, Epsillon-Aminocaproic acid' Epsilcapramin, NCGC00015092-01, NCGC00015092-03, NCGC00015092-04, NCGC00015092-05, NCGC00015092-06, NCGC00015092-07, NCGC00015092-09, NCGC00015092-10, NCGC00093587-01, NCGC00093587-02, NCGC00093587-03, NCGC00093587-04, NCGC00260767-01, 6-Aminohexanoic acid, >=98.5% (NT), AJ-26594, AMINOCAPROIC ACID (aminocaproic acid)., AN-16229, BC204341, BP-20395, KB-44629, SC-10067, ST075413, 008e238, SBI-0050070.P004, AB2000208, TL8003819, TR-020850, A0312, AB00051911, EU-0100082, FT-0620933, ST24045109, A15677, C02378, D00160, AB00051911-08, AB00051911_09, AB00051911_10, 101172-EP2302382A2, 101172-EP2302383A2, 319A820, 6-Aminocaproic acid, >=99% (titration), powder, 6-Aminocaproic acid, SAJ special grade, >=99.0%, SR-01000075688-1, SR-01000075688-3, SR-01000075688-6, F2191-0201, Amicar;|A-amino caproic acid;|A-Ahx;6-aminohexanoic acid, C3BDD377-8F43-4BEC-900A-D5850050BA82, Aminocaproic acid, European Pharmacopoeia (EP) Reference Standard, Aminocaproic acid, United States Pharmacopeia (USP) Reference Standard, InChI=1/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9, Amicar, A-amino caproic acid, A-Ahx, 6-aminohexanoic acid, Aminocaproic acid, Aminocaproic acid, Pharmaceutical Secondary Standard; Certified Reference Material, 87867-96-7, 93208-38-9, 6-azaniumylhexanoate, 6-aminocapronate, 6-ammoniohexanoate, AC1LANTE, epsilon-amino-N-caproate, 6-aminohexanoic acid zwitterion, CHEBI:57826, CJ-05179, CJ-23892


ID: 2107

chemical graph of compound 2107



InChIKey: SLYPOVJCSQHITR-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=C1O)OC(=O)S2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 72139
synonyms found at PubChem are:
Tioxolone, 4991-65-5, 6-Hydroxy-1,3-benzoxathiol-2-one, Thioxolone, 6-hydroxybenzo[d][1,3]oxathiol-2-one, Camyna, Tioxolon, Thioxalone, Tioxolona, Tioxolonum, 1,3-Benzoxathiol-2-one, 6-hydroxy-, Acnosan, Tioxolonum [INN-Latin], UNII-S0FAJ1R9CD, Tioxolona [INN-Spanish], 6-Hydro-2-oxo-1,3-benzoxathiole, C7H4O3S, 6-hydroxy-2H-1,3-benzoxathiol-2-one, EINECS 225-653-0, S0FAJ1R9CD, CHEMBL442687, CHEBI:568021, SLYPOVJCSQHITR-UHFFFAOYSA-N, NCGC00095003-01, 5-Hydroxy-1,3-benzothioxol-2-one, 6-hydroxybenzo[d]1,3-oxathiolen-2-one, SMR000718631, Tioxolone [INN:DCF], thidoxol, thioxolon, Tioxolone [INN:BAN:DCF], Psoil (Salt/Mix), Spectrum_001358, ACMC-209kiz, Tioxolone (INN/BAN), SpecPlus_000901, AC1L2HHM, AC1Q6HLN, Spectrum2_000450, Spectrum3_001025, Spectrum4_001156, Spectrum5_001539, D0M8UY, DSSTox_CID_25885, DSSTox_RID_81199, DSSTox_GSID_45885, SCHEMBL36433, 6-Hydroxy-2-oxobenzoxathiole, BSPBio_002809, KBioGR_001731, KBioSS_001838, cid_72139, MLS000766887, MLS002207047, MLS006011819, DivK1c_006997, SPECTRUM1503094, SPBio_000500, AC1Q798W, ZINC2181, DTXSID5045885, CTK8B1755, KBio1_001941, KBio2_001838, KBio2_004406, KBio2_006974, KBio3_002029, SLYPOVJCSQHITR-UHFFFAOYSA-, MolPort-000-198-907, HMS1922E09, HMS2233I16, HMS3656G22, Pharmakon1600-01503094, BCP27320, HY-B0483, KS-000013FH, Tox21_111384, ANW-30873, BBL027543, BDBM50252093, CCG-39965, NSC758240, s2603, SBB071406, STK525157, AKOS000120818, CS-2598, MCULE-4750186509, NE10413, NSC-758240, VZ30766, NCGC00095003-02, NCGC00095003-03, NCGC00095003-05, NCGC00095003-06, NCGC00178457-01, AJ-08140, KB-45519, LS-41601, SC-92492, ST088470, ZB000497, CAS-4991-65-5, SBI-0051902.P002, AB2000692, DB-051701, TC-060798, FT-0635501, ST24029784, V1364, 6-Hydroxy-1,3-benzoxathiol-2-one, >=98%, A15598, D07211, AB00052428-08, AB00052428-10, AB00052428_11, AB00052428_12, SR-01000842162, I06-1249, J-518772, SR-01000842162-2, BRD-K41876534-001-02-0, F0001-1301, Z955123730, InChI=1/C7H4O3S/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3,8H


ID: 2108

chemical graph of compound 2108



InChIKey: SMDHCQAYESWHAE-UHFFFAOYSA-N
SMILES: CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2319
synonyms found at PubChem are:
benfluralin, Bethrodine, Balan, BENEFIN, 1861-40-1, Benfluraline, Banafine, Benalan, Benefex, Benephin, Binnell, Bonalan, Carpidor, Flubalex, Balfin, Emblem, Quilan, N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline, Blulan, EL-110, Caswell No. 130, Benefin [WITHDRAWN], Benfluralin [BSI:ISO], N-Butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)benzenamine, Benfluraline [ISO-French], N-Butyl-2,6-dinitro-N-ethyl-4-trifluoromethylaniline, UNII-28224BUY6R, HSDB 407, Benzenamine, N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)-, N-Butyl-N-ethyl-2,6-dinitro-4-trifluoromethylaniline, BINNELL(R), QUILAN(R), EINECS 217-465-2, L 54521, EPA Pesticide Chemical Code 084301, BRN 2821329, N-Butyl-N-ethyl-alpha,alpha,alpha-trifluoro-2,6-dinitro-p-toluidine, SMDHCQAYESWHAE-UHFFFAOYSA-N, 28224BUY6R, alpha,alpha,alpha-Trifluoro-2,6-dinitro-N,N-ethylbutyl-p-toluidine, N-Butyl N-ethyl-2,6-dinitro-4-(trifluoromethyl)benzeneamine, DSSTox_CID_3899, p-Toluidine, N-butyl-N-ethyl-.alpha.,.alpha.,.alpha.-trifluoro-2,6-dinitro-, DSSTox_RID_77223, DSSTox_GSID_23899, N-BUTYL-N-ETHYL-A,A,A-TRIFLUORO-2,6-DINITRO-P-TOLUIDINE, p-Toluidine, N-butyl-N-ethyl-alpha,alpha,alpha-trifluoro-2,6-dinitro-, CAS-1861-40-1, team, Benafine, Benefine, Bhulan, CCRIS 9242, Pel-Tech, xl-2g, Spectrum_001829, BENEFIN(R), SpecPlus_000430, AC1L1DEU, BALAN(R), Spectrum2_001883, Spectrum3_000825, Spectrum4_000665, Spectrum5_001962, AC1Q1YN3, SCHEMBL55008, BSPBio_002349, KBioGR_001069, KBioSS_002334, SPECTRUM330033, DivK1c_006526, SPBio_001786, n-butyl-n-ethyl-2,6-dinitro-4-(trifluormethyl)anilin, CHEMBL1256668, DTXSID3023899, KBio1_001470, KBio2_002331, KBio2_004899, KBio2_007467, KBio3_001849, CHEBI:132878, ZINC3871674, Tox21_202270, Tox21_300774, CCG-39421, EL 110, AKOS015890700, ACM1861401, KF10035, NCGC00094527-01, NCGC00094527-02, NCGC00094527-03, NCGC00094527-04, NCGC00094527-05, NCGC00094527-06, NCGC00094527-07, NCGC00254678-01, NCGC00259819-01, AJ-46352, AN-50005, CC-24273, M011, AX8115326, LS-154330, FT-0603576, Benfluralin, PESTANAL(R), analytical standard, C21273, 861B401, C-20186, I01-8049, J-011946, 4-Trifluoromethyl-2,6-dinitro-N-ethyl-N-butylaniline, N-Butyl-N-ethyl-4-trifluoromethyl-2,6-trinitroaniline, N-Ethyl-N-butyl-2,6-dinitro-4-trifluoromethylaniline, 2,6-Dinitro-4-trifluoromethyl-N-n-butyl-N-ethylaniline, N-n-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline, N-Butyl-N-ethyl-|A,|A,|A-trifluoro-2,6-dinitro-p-toluidine, .alpha.,.alpha.,.alpha.-Trifluoro-2,6-dinitro-N,N-ethylbutyl-p-toluidine, Benzenamine, N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)- (9CI), N-Butyl-N-ethyl-.alpha.,.alpha.,.alpha.-trifluoro-2,6-dinitro-p-toluidine


ID: 2109

chemical graph of compound 2109



InChIKey: SMEROWZSTRWXGI-HVATVPOCSA-N
SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 9903
synonyms found at PubChem are:
LITHOCHOLIC ACID, 434-13-9, Lithocolic acid, Lithocholate, 3alpha-Hydroxy-5beta-cholanic acid, 3alpha-Hydroxy-5beta-cholan-24-oic acid, 3-Hydroxycholan-24-oic acid, 3alpha-Hydroxycholanic acid, 3-alpha-Hydroxycholanic acid, 5beta-Cholanic acid-3alpha-ol, NCI-C03861, 3alpha-Hydroxy-5beta-cholanoic acid, (3alpha,5beta)-3-hydroxycholan-24-oic acid, 3-alpha-Hydroxy-5-beta-cholanic acid, CCRIS 363, UNII-5QU0I8393U, 3alpha-Hydroxy-5beta-cholanate, 5-beta-Cholanic acid, 3-alpha-hydroxy-, Cholan-24-oic acid, 3-hydroxy-, (3alpha,5beta)-, HSDB 4113, 5beta-Cholan-24-oic acid, 3alpha-hydroxy-, EINECS 207-099-1, NSC683770, (3-alpha,5-beta)-3-Hydroxycholan-24-oic acid, NSC 657956, BRN 3217757, CHEMBL1478, 17beta-(1-Methyl-3-carboxypropyl)etiocholan-3alpha-ol, 17-beta-(1-Methyl-3-carboxypropyl)ethiocholan-3-alpha-ol, 3|A-Hydroxy-5|A-cholanic acid, CHEBI:16325, 5-beta-Cholan-24-oic acid, 3-alpha-hydroxy-, SMEROWZSTRWXGI-HVATVPOCSA-N, 5QU0I8393U, 5beta-Cholan-24-oic acid-3alpha-ol, NSC 683770, ST069335, DSSTox_CID_779, Cholan-24-oic acid, 3-hydroxy-, (3a,5b)-, DSSTox_RID_75786, DSSTox_GSID_20779, (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid, Litocholic acid, Cholan-24-oic acid, 3-hydroxy-, (3-alpha,5-beta)- (9CI), (4S)-4-((1S,2S,11S,5R,7R,10R,14R,15R)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0. 0<2,7>.0<11,15>]heptadec-14-yl)pentanoic acid, (R)-4-((3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, SR-05000000450, (3beta,5beta,14beta,17alpha)-3-Hydroxycholan-24-Oic Acid, NSC657956, NSC-683770, Prestwick_88, 4OA, CAS-434-13-9, Lithocholic Acid,(S), 4q0a, Prestwick0_000796, Prestwick1_000796, Prestwick2_000796, Prestwick3_000796, Spectrum5_002021, Bevacizumab + Trastuzumab, 3|A-Hydroxycholanic Acid, bmse000686, D04SLF, D0K9CR, UPCMLD-DP153, AC1L1U2Z, cid_9903, Lithocholic acid, >=95%, BIDD:PXR0054, SCHEMBL28449, BSPBio_000932, GTPL611, 4-10-00-00785 (Beilstein Handbook Reference), MLS002154006, 3.alpha.-Hydroxycholanic acid, 3a-Hydroxy-5 -cholanic acid, SPBio_002871, BPBio1_001026, 3a-hydroxy-5b-cholan-24-oate, DTXSID6020779, UPCMLD-DP153:001, 3alphahydroxy-5beta-cholanic acid, BIA0111, 3|A-Hydroxy-5|A-cholanoic Acid, MolPort-001-794-648, ZX-AFC000913, HMS1570O14, HMS2097O14, HMS2269C14, HMS3714O14, 5 --Cholan-24-oic acid-3a-ol, 3|A-Hydroxy-5|A-cholan-24-oate, 3a-hydroxy-5b-cholan-24-oic acid, HY-B0172, ZINC3918156, 5|A-Cholan-24-oic acid-3|A-ol, Tox21_201868, Tox21_302791, 3a-Hydroxy-5 -cholan-24-oic acid, 5.beta.-Cholanic acid-3.alpha.-ol, BDBM50236238, LMST04010003, LS-118, MFCD00003682, s4003, SBB012598, (3a,5b)-3-hydroxy-cholan-24-oate, AKOS016010251, 3|A-Hydroxy-5|A-cholan-24-oic acid, CCG-220796, CS-2049, DS-3878, 3.alpha.-Hydroxy-5.beta.-cholanic acid, NCGC00091272-01, NCGC00091272-04, NCGC00091272-06, NCGC00091272-07, NCGC00091272-08, NCGC00256451-01, NCGC00259417-01, (3a,5b)-3-hydroxy-cholan-24-oic acid, 3.alpha.-Hydroxy-5.beta.-cholanoic acid, AJ-47431, AK114674, M622, NCI60_028903, NCI60_030095, SC-90635, SMR000112168, (3|A,5|A)-3-Hydroxycholan-24-oic Acid, 5.beta.-Cholan-24-oic acid-3.alpha.-ol, AX8136511, TR-016841, L0089, 5-.beta.-Cholanic acid, 3-.alpha.-hydroxy-, 3.alpha.-Hydroxy-5.beta.-cholan-24-oic acid, C03990, 5.beta.-Cholan-24-oic acid, 3.alpha.-hydroxy-, C-30015, 17|A-(1-Methyl-3-carboxypropyl)etiocholan-3|A-ol, SR-05000000450-2, SR-05000000450-4, SR-05000000450-5, cho lan-24-oic acid, 3-hydroxy-, (3alpha,5beta)-, Cholan-24-oic acid, 3-hydroxy-, (3-alpha,5-beta)-, UNII-JIY1ILR284 component SMEROWZSTRWXGI-HVATVPOCSA-N, 17-.beta.-(1-Methyl-3-carboxypropyl)ethiocholan-3-.alpha.-ol, Cholan-24-oic acid, 3-hydroxy-, (3-.alpha., 5-.beta.)-, (3alpha,5alpha,8alpha,14beta,17alpha)-3-hydroxycholan-24-oic acid, Lithocholic acid, European Pharmacopoeia (EP) Reference Standard, AC268B61-0548-4391-90E9-546636926870, Lithocholic acid, 50 mug/mL in methanol, certified reference material, (4R)-4-((3R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, LCA


ID: 2110

chemical graph of compound 2110



InChIKey: SMOFGXHPWCTYQD-UHFFFAOYSA-N
SMILES: COC1=C(C(=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5318834
synonyms found at PubChem are:
Koparin, 65048-75-1, 3-(2,3-dihydroxy-4-methoxyphenyl)-7-hydroxy-4H-chromen-4-one, AC1NSXC6, Spectrum2_000299, SPECTRUM200422, SPBio_000238, SCHEMBL5723673, CHEMBL1354502, CCG-39857, LMPK12050086, SDCCGMLS-0066413.P001, NCGC00095474-01, SR-05000002555, SR-05000002555-1, BRD-K62331715-001-02-1, 3-(2,3-dihydroxy-4-methoxyphenyl)-7-hydroxychromen-4-one


ID: 2111

chemical graph of compound 2111



InChIKey: SMQUZDBALVYZAC-UHFFFAOYSA-N
SMILES: C1=CC=C(C(=C1)C=O)O

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MJ Kurth" "LJ Galietta" "MJ Haddadin" "MF Springsteel" "MH Nantz" "K By" "AS Verkman" "M Eda" "EJ Niedzinski"


CID is 6998
synonyms found at PubChem are:
SALICYLALDEHYDE, 2-Hydroxybenzaldehyde, 90-02-8, o-Hydroxybenzaldehyde, o-Formylphenol, Salicylal, 2-Formylphenol, Benzaldehyde, 2-hydroxy-, Salicylic aldehyde, Salicyladehyde, 2-HYDROXY-BENZALDEHYDE, Benzaldehyde, o-hydroxy-, Salicylaldehyd, Salizylaldehyd, Benzaldehyde, hydroxy-, NSC 49178, UNII-17K64GZH20, FEMA No. 3004, CCRIS 7451, HSDB 721, 2-hydroxy benzaldehyde, EINECS 201-961-0, BRN 0471388, AI3-02174, CHEMBL108925, CHEBI:16008, SMQUZDBALVYZAC-UHFFFAOYSA-N, 17K64GZH20, DSSTox_CID_1792, DSSTox_RID_76329, 2,4-Cyclohexadien-1-one, 6-(hydroxymethylene)-, DSSTox_GSID_21792, 28777-87-9, Hydroxybenzaldehyde, CAS-90-02-8, 111268-93-0, NK, salicyl aldehyde, hydroxylbenzaldehyde, hydroxy benzaldehyde, hydroxyl benzaldehyde, 2-hyroxy-benzaldehyde, 2-oxidanylbenzaldehyde, Salicylaldehyde, 8CI, 2- hydroxybenzaldehyde, ACMC-20me6q, AC1L1NRV, WLN: VHR BQ, bmse000677, EC 201-961-0, SCHEMBL15395, 4-08-00-00176 (Beilstein Handbook Reference), KSC204S9R, AC1Q6Q92, AC1Q78A0, Salicylaldehyde, >=98%, FG, Salicylaldehyde, 99% 100g, DTXSID1021792, CTK0D4077, CTK1A4998, FEMA 3004, MolPort-000-871-199, Salicylaldehyde, p.a., 99.0%, ZINC896073, ACMC-209783, CS-D1188, NSC49178, Salicylaldehyde, analytical standard, Tox21_201737, Tox21_302929, ANW-13633, BBL027432, BDBM50139367, MFCD00003317, NSC-49178, NSC187662, RW2543, Salicylaldehyde, reagent grade, 98%, SBB040225, STL194289, AKOS000119187, 2-hydroxybenzaldehyde (salicylaldehyde), AS03003, EBD2205190, LS-3090, MCULE-8965879140, NSC-187662, RL05659, RTR-038301, TRA0028440, KS-0000005P, NCGC00249108-01, NCGC00256460-01, NCGC00259286-01, AJ-24221, AN-24183, AS-13997, K615, SC-18113, ZB015070, KB-230927, ST2410040, TR-038301, FT-0648915, S0004, S0275, Salicylaldehyde, redist., >=99.0% (GC), ST50213374, 7293-EP2270014A1, 7293-EP2281563A1, 7293-EP2301933A1, 7293-EP2308872A1, 7293-EP2311807A1, 7293-EP2311827A1, 7293-EP2316459A1, 7293-EP2316829A1, 90S028, C06202, H-3700, 96428-EP2295429A1, 96428-EP2305629A1, 116358-EP2374783A1, 116358-EP2377841A1, A843413, I01-4510, F2190-0607, InChI=1/C7H6O2/c8-5-6-3-1-2-4-7(6)9/h1-5,9, 27761-48-4


ID: 2112

chemical graph of compound 2112



InChIKey: SNGGBKYQZVAQKA-UHFFFAOYSA-N
SMILES: C1CC(CN(C1)CCC=C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6917797
synonyms found at PubChem are:
85375-15-1, SKF 89976A hydrochloride, 1-(4,4-Diphenylbut-3-en-1-yl)piperidine-3-carboxylic acid hydrochloride, SKF-89976A, 1-(4,4-Diphenyl-3-butenyl)-3-piperidinecarboxylic acid hydrochloride, SKF 89976A HCl, SKF89976A (hydrochloride), 1-(4,4-diphenylbut-3-enyl)piperidine-3-carboxylic acid hydrochloride, C22H26ClNO2, 1-(4,4-Diphenyl-3-buten-1-yl)-3-piperidinecarboxylic acid hydrochloride, CHEMBL543557, SMR000326919, SR-01000076217, AC1OCEO0, EU-0101151, SKF89976A(hydrochloride), MLS000860061, MLS006010709, SCHEMBL10964540, CTK8C4819, KS-00001CLC, DTXSID60426065, SK&F 89976-A, hydrochloride, MolPort-003-959-631, SNGGBKYQZVAQKA-UHFFFAOYSA-N, BCP02921, SK&F-89976A, Tox21_501151, ANW-73232, BN0612, MFCD01321071, AKOS016008496, API0008304, CS-6040, HY-100228A, LP01151, TRA0077645, NCGC00094414-01, NCGC00261836-01, AC-27756, BCP0726000297, AX8050759, KB-214138, LS-114699, TC-161977, SKF-89976A, >98% (HPLC), solid, ST24037269, X6861, S 9066, SR-01000076217-1, SR-01000076217-3, 1-(4,4-diphenyl-3-butenyl)-3-piperidine carboxylic acid hydrochloride, 1-(4,4-diphenyl-3-butenyl)-3-piperidinecarboxylic acid hydrochloride?SKF 89976A HCl


ID: 2113

chemical graph of compound 2113



InChIKey: SNHRLVCMMWUAJD-SUYDQAKGSA-N
SMILES: CCCCC(=O)O[C@@]1([C@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)C(=O)CO

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 16533
synonyms found at PubChem are:
BETAMETHASONE VALERATE, Betamethasone 17-valerate, 2152-44-5, Betnovate, Betaderm, Luxiq, beta-Val, Celestoderm, Bedermin, Betatrex, Bextasol, Valnac, Betnovateat, Dermovaleas, Betneval, Dermosol, Tokuderm, Betamethasone-17-valerate, Celeston valerate, beta-Methasone 17-valerate, Ecoval 70, Topagen (Veterinary), Gentocin (Veterinary), UNII-9IFA5XM7R2, 9IFA5XM7R2, C27H37FO6, CHEBI:31277, SNHRLVCMMWUAJD-SUYDQAKGSA-N, Betamethasone valerate (Betnovate), EINECS 218-439-3, [(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] pentanoate, Pregna-1,4-diene-3,20-dione, 9-fluoro-11,21-dihydroxy-16-methyl-17-((1-oxopentyl)oxy)-, (11beta,16beta)-, 9alpha-Fluoro-16beta-methylprednisolone 17-valerate, 1,4-Pregnadiene-11beta,17alpha,21-triol-9alpha-fluoro-16beta-methyl-3,20-dione 17-valerate, 9-Fluoro-11-beta,17,21-trihydroxy-16-beta-methylpregna-1,4-diene-3,20-dione-17-valerate, 9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 17-valerate, 9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione-17-valerate, 9-fluoro-11beta,21-dihydroxy-16beta-methyl-3,20-dioxopregna-1,4-dien-17-yl pentanoate, 9-fluoro-11beta,21-dihydroxy-16beta-methyl-3,20-dioxopregna-1,4-dien-17-yl valerate, Flubenisolonvalerate, (2S,10S,11S,13S,15S,17S,1R,14R)-1-fluoro-17-hydroxy-14-(2-hydroxyacetyl)-2,13, 15-trimethyl-5-oxotetracyclo[8.7.0.0<2,7>.0<11,15>]heptadeca-3,6-dien-14-yl pe ntanoate, 9alpha-Fluoro-16beta-methyl-11beta,17alpha,21-trihydroxy-1,4-pregnadiene-3,20-dione 17-valerate, Betamethasone Valerate (Betamethasone 17-Valerate), entanoate, Bettamousse, Betaval, Fuciderm, Stanoval, Betoid, Celestoderm V, Celestoderm-V, Betnesol V, Betnesol-V, Celestan V, Celestan-V, Celestane V, Rinderon V, NCGC00274064-01, Rinderon-V (TN), Luxiq (TN), Topagen (Salt/Mix), Beta-Val (TN), Betatrex (Salt/Mix), Gentocin (Salt/Mix), Chlorophytum Borivilanum, Betamethason-17-valerate, DSSTox_CID_2673, Betamethasone 17a-valerate, D03SXE, SCHEMBL7270, CHEMBL1497, DSSTox_RID_76684, DSSTox_GSID_22673, Betamethasone 17alpha-valerate, AC1L285F, DTXSID7022673, MolPort-003-933-651, Betnovate;Celestone;Betaderm;Luxiq, ZINC3882052, Betamethasone valerate (JP17/USP), Tox21_302288, MFCD00867446, s1690, AKOS015994704, KS-1198, RL02645, Betamethasone valerate [USAN:BAN:JAN], Betamethasone valerate [USAN:USP:JAN], NCGC00255185-01, AN-14218, ST075178, CAS-2152-44-5, AB2000222, LS-118456, D01357, AB01274710-01, AB01274710_02, 152M445, BRD-K34032314-001-04-1, (11.beta.,16.beta.)-9.alpha.-Fluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione 17.alpha.-valerate, (11beta,16beta)-9-fluoro-11,21-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl pentanoate, (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl p, (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl pentanoate, 12772-60-0, 149665-14-5, 9-Fluoro-11.beta.,17,21-trihydroxy-16.beta.-methylpregna-1,4-diene-3,20-dione 17-valerate, 9-Fluoro-11.beta.,21-dihydroxy-16.beta.-methyl-3,20-dioxopregna-1,4-dien-17-yl pentanoate #, 944728-94-3, Pregna-1,4-diene-3,20-dione, 9-fluoro-11,21-dihydroxy-16-methyl-17-((1-oxopentyl)oxy)-,(11-beta,16-beta)-


ID: 2114

chemical graph of compound 2114



InChIKey: SNJIJYKMYQRHRC-UHFFFAOYSA-M
SMILES: CC(CC1=CC=C(C=C1)OCC(=O)[O-])NCC(C2=CC(=CC=C2)Cl)O.[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2436
synonyms found at PubChem are:
BRL 37344 sodium, BRL 37344 sodium salt, 127299-93-8, AC1L1DO8, CHEMBL1445411, CTK8E7228, DTXSID80274368, HMS3260H15, Tox21_500197, AKOS025294254, CCG-204292, LP00197, amino]propyl]phenoxy]-acetic acid sodium, NCGC00015133-02, NCGC00015133-03, NCGC00015133-04, NCGC00093673-01, NCGC00093673-02, NCGC00260882-01, RT-011817, B-169, EU-0100197, J-005478, ( inverted question mark)-(R*,R*)-[4-[2-[[2-(3-Chlorophenyl)-2-hydroxyethyl], sodium 2-[4-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]phenoxy]acetate


ID: 2115

chemical graph of compound 2115



InChIKey: SNPLKNRPJHDVJA-ZETCQYMHSA-N
SMILES: CC(C)(CO)[C@H](C(=O)NCCCO)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 131204
synonyms found at PubChem are:
Dexpanthenol, D-Panthenol, Pantothenol, 81-13-0, Bepanthen, D-Pantothenyl alcohol, Ilopan, (+)-Panthenol, Bepanthene, Bepantol, Thenalton, Zentinic, Cozyme, Motilyn, Panadon, Pantol, Provitamin B, Panthoderm, Pantothenyl alcohol, panthenol, Synapan, D-P-A Injection, D(+)-Panthenol, Pantenyl, D(+)-Pantothenyl alcohol, d-Pantothenol, d panthenol, D-Panthenol 50, (R)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, N-Pantoyl-propanolamine, Urupan, Panthenol (D), Propanolamine, N-pantoyl-, (2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, UNII-1O6C93RI7Z, Panthenol (JAN), Pantothenylol, Intrapan, Prestwick_529, Ilopan (TN), D-(+)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, Provitamin B5, Dextro pantothenyl alcohol, Alcopan-250, NSC 302962, Butanamide, 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-, (2R)-, Dexpantenol, Dexpanthenolum, 1O6C93RI7Z, CHEBI:27373, Pantothenol, D-, SNPLKNRPJHDVJA-ZETCQYMHSA-N, Pro-itamin B5, component of Pantho-F, NCGC00142622-03, 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, (R)-, 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, D-(+)-, Butanamide, 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-, (R)-, Butyramide, 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-, D-(+)-, DSSTox_CID_2906, Dexpantenol [INN-Spanish], Dexpanthenolum [INN-Latin], DSSTox_RID_76783, DSSTox_GSID_22906, Q-201048, CCRIS 3947, HSDB 296, (R)-2,4-Dihydroxy-3,3-dimethylbutyric 3-hydroxypropylamide, Sinecort, (R)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, EINECS 201-327-3, component of Zentinic, Panthenol, (+)-, BRN 1724947, N-Pantoyl-3-propanolamine, (R)-2,4-Dihydroxy-N-(3-hydroxy-propyl)-3,3-dimethylbutanamide, Dexpanthenol;, NSC302962, D(+)-alpha,gamma-Dihydroxy-N-(3-hydroxypropyl)-beta,beta-dimethylbutyramide, alpha,gamma-Dihydroxy-N-(3-hydroxypropyl)-beta,beta-dimethylbutyramide, D-(+)-, CAS-81-13-0, NCGC00186658-01, Dexpanthenol [USAN:USP:INN:BAN], Dexpanthenol (USP), I notEuEOO- B, BAY 81-2996, Panthenol, (+ )-, AC1L2YRI, Prestwick0_000022, Prestwick1_000022, Prestwick2_000022, Prestwick3_000022, Dexpanthenol (USP/INN), D-Panthenol USP/BP/IP, bmse000445, EC 201-327-3, AC1Q5PG6, OOEthy. masculine (1/4), SCHEMBL15861, BSPBio_000083, 4-04-00-01652 (Beilstein Handbook Reference), SPBio_002004, (R)-(+)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, BPBio1_000093, Butanamide, 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-, (theta)-, CHEMBL1200979, Dexpanthenol - USP/FCC Kosher, DTXSID3022906, CTK0H4656, MolPort-003-666-677, Dexpanthenol (Pantothenyl Alcohol), HMS1568E05, HMS2094E09, HMS2095E05, HMS3712E05, OOEthy. masculineo pound (1/4), HY-B1391, ZINC1530303, D-Panthenol, >=98.0% (NT), Tox21_111563, LMFA08020198, MFCD00065006, s4695, SBB012405, AKOS015841507, AKOS015901947, Calcium D-Pantothenate USP/BP/EP/IP, Tox21_111563_1, API0002283, CCG-213429, CS-8175, DB09357, KS-00000L92, NCGC00142622-01, NCGC00142622-04, AJ-26649, AK113720, AS-14732, BC219267, CC-26375, CJ-23957, M365, SC-18189, ST072186, Dexpanthenol, tested according to Ph.Eur., SBI-0206936.P001, AX8043145, KB-209778, ST2414430, TC-165573, D-Panthenol, Vetec(TM) reagent grade, 98%, FT-0625596, P0692, C05944, D00193, C-27429, I14-13305, A6CF1A81-5B98-4C28-A379-EA28FA9DD210, (R)-3-(2,4-Dihydroxy-3,3-dimethylbutyramido)-1-propanol, UNII-WV9CM0O67Z component SNPLKNRPJHDVJA-ZETCQYMHSA-N, Dexpanthenol, European Pharmacopoeia (EP) Reference Standard, (2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-butanamide, (R)-()-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, (R)-(+)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, (R)-2,4-Dihydroxy-N-(3-hydroxy-propyl)-3,3-dimethyl-butyramide, d(+)-2,4-dihydroxy-n-(3-hydroxypropyl)-3,3-dimethylbutyramide, D-(+)-2,4-Dihydroxy-3,3-dimethyl-N-(3-hydroxypropyl)butyramide, D-Panthenol, >=98% (perchloric acid titration), >=98% (TLC), Dexpanthenol, United States Pharmacopeia (USP) Reference Standard, (D)-(+)-2, 4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, Dexpanthenol, Pharmaceutical Secondary Standard; Certified Reference Material, (R)-(+)-2,4- paragraph signthornoC>>u-N-(3-oC>>u+/-u>>u)-3,3- paragraph signthorn(1/4)x>>u paragraph sign inverted exclamation marko pound degrees ., 17307-32-3, 50584-68-4


ID: 2116

chemical graph of compound 2116



InChIKey: SNUHZNCSBAQVJV-DPGSLPGRSA-N
SMILES: CC(=O)/C=C\[C@@H]1[C@]2(CCCC(C2CC[C@@]1(C)O)(C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6857787
synonyms found at PubChem are:
8-HYDROXY-15,16-BISNOR-11-LABDEN-13-ONE, AC1OAH7A, Spectrum5_001614, BSPBio_002855, SPECTRUM300060, CHEMBL3039484, CCG-38554, SDCCGMLS-0066873.P001, NCGC00178431-01, SR-05000002526, SR-05000002526-1, BRD-A61864215-001-02-9, (Z)-4-[(1R,2R,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one


ID: 2117

chemical graph of compound 2117



InChIKey: SOEDEYVDCDYMMH-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=C1O)OC(=C(C2=O)O)C3=CC(=C(C(=C3)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5281692
synonyms found at PubChem are:
Robinetin, 490-31-3, Norkanugin, 3,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one, 5-Deoxymyricetin, 5-Hydroxyfisetin, 4H-1-Benzopyran-4-one, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-, UNII-KJ6DBC4U7E, 3,7,3',4',5'-pentahydroxyflavone, 3,3',4',5',7-Pentahydroxyflavone, NSC 407331, NSC 656274, CCRIS 7520, EINECS 207-709-6, KJ6DBC4U7E, NSC-407331, BRN 0308905, CHEBI:8876, CHEMBL170405, FLAVONE, 3,3',4',5',7-PENTAHYDROXY-, NSC656274, 3,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)-4-benzopyrone, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one, 3,7-Dihydroxy-2-(3,4,5-trihydroxy-phenyl)-chromen-4-one, 3,7,3',4',5'-Pentahydroxuflavone, AC1NQYWM, D07NAY, 5-18-05-00562 (Beilstein Handbook Reference), SCHEMBL217743, DTXSID30197654, MolPort-004-960-055, SOEDEYVDCDYMMH-UHFFFAOYSA-N, ZINC4098600, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one, BDBM50033767, LMPK12111577, NSC407331, AKOS016009494, Flavone,3',4',5',7-pentahydroxy-, CCG-208323, MCULE-2330347941, NSC-656274, NCGC00163615-01, 4CN-0354, AJ-48014, AK112322, LS-69031, 3,7,3'',4'',5''-Pentahydroxyflavone, 3,3'',4'',5'',7-pentahydroxy flavone, AX8150478, KB-234373, FT-0724738, ST24041297, W1691, C10177, WLN: T66 BO EVJ CR CQ DQ EQ& DQ IQ, SR-05000002311, SR-05000002311-2, 4H-1-Benzopyran-4-one, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl), 4H-1-Benzopyran-4-one, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)- (9CI)


ID: 2118

chemical graph of compound 2118



InChIKey: SORAZNWVQFKAFD-JBDLWBSISA-N
SMILES: CCN(CC)C(=O)N[C@@H]1CC2C(CC3=CNC4=CC=CC2=C34)N(C1)C.C(=C\C(=O)O)\C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 45105101
synonyms found at PubChem are:
S(-)-terguride hydrogen maleate, HMS1570J16


ID: 2119

chemical graph of compound 2119



InChIKey: SOYAGMVKMXZVNZ-UHFFFAOYSA-N
SMILES: CCC(C(C1=CC(=C(C=C1)O)O)O)NC(C)C.CS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 23702
synonyms found at PubChem are:
Isoetharine mesylate salt, ISOETHARINE MESYLATE, 7279-75-6, Isotharine mesylate, Isoetarine mesilate, C13H21NO3.CH4O3S, MLS000069674, SMR000058457, Bronkometer (TN), EINECS 230-695-8, 4-[1-Hydroxy-2-[(1-methylethyl)amino]butyl]-1,2-benzenediol mesylate salt, 4-[1-HYDROXY-2-([1-METHYLETHYL]AMINO)BUTYL]-1,2-BENZENEDIOL METHANESULFONATE, Isoetharine mesylate (USP), SR-01000000183, Isoetharine mesylate [USAN:BAN], 3,4-Dihydroxy-alpha-(1-(isopropylamino)propyl)benzyl alcohol methanesulfonate (salt), NCGC00017071-01, CAS-7279-75-6, Prestwick_1003, 4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;methanesulfonic acid, Opera_ID_1465, AC1L2MV5, DSSTox_CID_25571, DSSTox_RID_80968, DSSTox_GSID_45571, MLS001146940, SCHEMBL212005, REGID_for_CID_23702, CHEMBL1201153, DTXSID2045571, CTK8G0377, 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)-butyl)-, methanesulfonate (salt), HMS1570E20, HMS2093J16, HMS2097E20, HMS2230F06, HMS3262G03, HMS3714E20, Pharmakon1600-01505977, Tox21_110768, Tox21_500671, 2481AH, MFCD00133422, NSC759286, AKOS015889242, API0008431, CCG-213584, LP00671, NSC-759286, NCGC00016157-02, NCGC00094032-01, NCGC00261356-01, LS-176993, EU-0100671, D04626, I 3639, SR-01000000183-2, SR-01000000183-4, SR-01000000183-6, I01-18976, 4-(1-hydroxy-2-(isopropylamino)butyl)benzene-1,2-diol methanesulfonate, 4-[1-Hydroxy-2-[(1-methylethyl)amino]butyl]-1,2-benzenediol mesylate, 4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol; methanesulfonic acid


ID: 2120

chemical graph of compound 2120



InChIKey: SPIFQXPRSJKRAO-UHFFFAOYSA-N
SMILES: CCCC(=O)NCCC1=C2C3=CC=CC=C3CCCN2C4=C1C=C(C=C4)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5311198
synonyms found at PubChem are:
K 185, K185, CHEMBL274438, 32223-82-8, K-185, N-[2-(11-methoxy-6,7-dihydro-5H-indolo[2,1-a][2]benzazepin-13-yl)ethyl]butanamide, K 185, solid, AC1NSK6Z, Lopac-K-1888, D0WE4C, Lopac0_000696, GTPL1359, CTK8G0422, DTXSID80415512, SPIFQXPRSJKRAO-UHFFFAOYSA-N, HMS3262K13, ZINC2511691, Tox21_500696, BDBM50086001, CCG-204781, LP00696, NCGC00015579-01, NCGC00015579-02, NCGC00015579-03, NCGC00015579-04, NCGC00094050-01, NCGC00094050-02, NCGC00261381-01, EU-0100696, K 1888, L000326, SR-01000075950, SR-01000075950-1, N-[2-(10-Methoxy-6,7-dihydro-5H-7a-azadibenzo[a,e]azulene-12-yl)ethyl]butanamide, N-[2-(11-Methoxy-6,7-dihydro-5H-benzo[3,4]azepino[1,2-a]indol-13-yl)-ethyl]-butyramide, N-Butanoyl 2-(5,6,7-trihydro-11-methoxybenzo[c]cyclohept-[2,1-a]-indol-13-yl)ethanamine, N-Butanoyl 2-(5,6,7-trihydro-11-methoxybenzo[c]cyclohept[2,1-a]indol-13-yl)ethanamine


ID: 2121

chemical graph of compound 2121



InChIKey: SPXACGZWWVIDGR-SPZWACKZSA-N
SMILES: CC(C)[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@@H]5C[C@H]6[C@@H](CC7=CNC8=CC=CC6=C78)N(C5)C.CS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 444034
synonyms found at PubChem are:
DIHYDROERGOCRISTINE MESYLATE, 24730-10-7, Dihydroergocristinmesilat, UNII-DS7CL18UAM, Dihydroergocristine mesilate, MLS000069354, 9,10-Dihydroergocristine methanesulfonate, DS7CL18UAM, SMR000058240, CHEBI:31490, Dihydroergocristine methanesulfonate salt, 5'alpha-Benzyl-9,10alpha-dihydro-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione monomethanesulphonate, Dihydroergocristine methanesulfonate, SR-01000075381, Diertine (TN), Prestwick_745, Opera_ID_1422, AC1L9FL7, MLS001076298, MLS001333686, MLS002222256, SCHEMBL178144, cid_444034, CHEMBL1255837, BDBM30706, DTXSID20872322, 9,10-dihydroergocristine mesilate, 9,10-dihydroergocristine mesylate, MolPort-000-763-385, HMS1569B06, HMS2096B06, HMS2233K22, Dihydroergocristine mesilate (BAN), AKOS024458318, CCG-208194, NCGC00025380-03, AN-18718, ST056345, D-155, EU-0100409, MLS000069354-02, C13168, D07833, SR-01000000009, J-015650, SR-01000000009-2, SR-01000075381-1, UNII-X3S33EX3KW component SPXACGZWWVIDGR-SPZWACKZSA-N, Dihydroergocristine mesilate, European Pharmacopoeia (EP) Reference Standard, (10alphaH)-5'alpha-benzyl-12'-hydroxy-3',6',18-trioxo-2'-(propan-2-yl)-9,10-dihydroergotaman methanesulfonate, (5'?,10?)-9,10-Dihydro-12'-hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)-ergotaman-3',6',18-trione mesylate, (6aR,9R,10aR)-N-((2R,5S,10aS,10bS)-5-benzyl-10b-hydroxy-2-isopropyl-3,6-dioxooctahydro-2H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl)-7-methyl-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinoline-9-carboxamide methanesulfonate, (6aR,9R,10aR)-N-[(2R,5S,10aS,10bS)-5-Benzyl-10b-hydroxy-2-(1-methylethyl)-3,6-dioxo-octahydro-8H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-7-methyl-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinoline, 22288-21-7, 25377-54-2, 27400-83-5


ID: 2122

chemical graph of compound 2122



InChIKey: SQFSKOYWJBQGKQ-UHFFFAOYSA-N
SMILES: COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5281666
synonyms found at PubChem are:
Kaempferide, 491-54-3, Kaempferid, 4'-Methylkaempferol, 4'-O-Methylkaempferol, Kaempferol 4'-methyl ether, Campheride, Kaemperide, Kempferide, UNII-508XL61MPD, 4'-Methoxy-3,5,7-trihydroxyflavone, NSC 407294, KAMPFERIDE, 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(4-methoxyphenyl)-, 5,7-Dihydroxy-4'-methoxyflavonol, 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one, EINECS 207-738-4, BRN 0305378, 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4-benzopyrone, CHEMBL40919, Flavone, 3,5,7-trihydroxy-4'-methoxy-, 508XL61MPD, CHEBI:6099, FLAVANONE, 4'-METHOXY-3,5,7-TRIHYDROXY-, 3,5,7-trihydroxy-2-(4-methoxyphenyl)chromen-4-one, 3,5,7-Trihydroxy-4'-methoxyflavone, NSC407294, NSC-407294, 3,5,7-TRIHYDROXY-2-(4-METHOXY-PHENYL)-CHROMEN-4-ONE, 4'-Methoxykaempferol, Kaemferide, Kampheride, Kaempferol 4'-O-methyl ether, 4'-Methoxy-3',5,7-trihydroxyflavone, AC1NQYUM, D04DYO, Kaempferol 4''-methyl ether, 5-18-05-00253 (Beilstein Handbook Reference), SCHEMBL426774, Kaempferide, analytical standard, DTXSID9034155, CTK7A3406, MolPort-000-165-394, SQFSKOYWJBQGKQ-UHFFFAOYSA-N, BCP20573, ZINC6411540, BDBM50084978, CK-008, LMPK12110563, 3 5 7-trihydroxy-4'-methoxyflavone, Flavone,5,7-trihydroxy-4'-methoxy-, AKOS015903441, 3,5,7-Trihydroxy-4'-methoxy-Flavone, API0003064, CS-0957, MCULE-9836342232, VA11124, KS-00000I07, 4'-Methoxy-3,5,7-trihydroxy-Flavanone, 4CN-0210, HY-15449, LS-68935, ST085668, AB0102453, FT-0625213, N1286, WLN: T66 BO EVJ CR DO1& DQ GQ IQ, C10098, W-5043, A827662, I14-19013, 1.3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4-benzopyrone, 2-(4-methoxyphenyl)-3,5,7-tris(oxidanyl)chromen-4-one, 3,5,7-trihydroxy-2-(4-methoxyphenyl)-1-benzopyran-4-one, 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one #, 4H-1-Benzopyran-4-one,3,5,7-trihydroxy-2-(4-methoxyphenyl)-, 4H-1-Benzopyran-4-one,5,7-trihydroxy-2-(4-methoxyphenyl)-, 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one, 9CI, 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(4-methoxyphenyl)- (9CI)


ID: 2123

chemical graph of compound 2123



InChIKey: SQMWSBKSHWARHU-SDBHATRESA-N
SMILES: C1CCC(C1)NC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 657378
synonyms found at PubChem are:
N6-Cyclopentyladenosine, 41552-82-3, (2R,3R,4S,5R)-2-(6-(Cyclopentylamino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol, Cyclopentyladenosine, n-cyclopentyladenosine, CHEMBL68738, MLS000028368, N(6)-Cyclopentyladenosine, SMR000058639, (2R,3R,4S,5R)-2-[6-(cyclopentylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol, Adenosine, N-cyclopentyl-, N6-CyclopentylAdo, n-cyclopentyl-adenosine, n6-cyclopentyl-adenosine, AC1LCWG1, Opera_ID_1056, D03RFA, GTPL380, MLS001077332, MLS002153196, SCHEMBL120481, N6-cyclopentyladenosine (CPA), N6-Cyclopentyladenosine, solid, cid_657378, BDBM25400, CTK1D5898, MolPort-023-276-193, SQMWSBKSHWARHU-SDBHATRESA-N, HMS2232M15, ZINC3995996, 5720AB, MFCD00036845, PDSP1_001069, PDSP2_001053, AKOS016009596, NCGC00023909-04, NCGC00023909-05, NCGC00023909-06, AC-27402, AJ-47612, LS-15119, AX8142877, KB-206470, ST24026157, J-523544, (2R,3R,4S,5R)-2-[6-(cyclopentylamino)-9H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol, 3GU


ID: 2124

chemical graph of compound 2124



InChIKey: SRGKFVAASLQVBO-BTJKTKAUSA-N
SMILES: CN(C)CCC(C1=CC=C(C=C1)Br)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5281067
synonyms found at PubChem are:
Brompheniramine maleate, 980-71-2, Brompheniramine hydrogen maleate, Dimetane, Rolabromophen, Dimotane, Drauxin, Gammistin, Nagemid, Spentane, Allent, Ebalin, Dimetane-ten, Parabromdylamine maleate, Veltane, Ilvin, Drixoral Syrup, Brompheniramine (maleate), Dimetapp Allergy, Dimetane Extentabs, Lodrane, Brompheniramine maleate [USP], EINECS 213-562-9, MLS000028423, CHEBI:3184, (+/-)-Brompheniramine maleate salt, SMR000058417, 2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate, 2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate (1:1), 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (+-)-, (Z)-2-butenedioate (1:1), 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (Z)-butenedioate (1:1), W-100095, (+-)-2-p-Bromo-alpha-2-(dimethylamino)ethylbenzylpyridine maleate (1:1), Pyridine, 2-(p-bromo-alpha-(2-(dimethylamino)ethyl)benzyl)-, maleate (1:1), 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (+-)-, (Z)-butenedioate (1:1), 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (2Z)-2-butenedioate (1:1), d-Brompheniramine maleate, l-Brompheniramine maleate, Bromopheniramine maleate, SR-01000003057, Brompheniramine d-form maleate, EINECS 219-236-2, 3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine;(Z)-but-2-enedioic acid, Dimetane (TN), Prestwick_913, 3-(4-bromophenyl)-N,N-dimethyl-3-(pyridin-2-yl)propan-1-amine maleate, Brompheniramine fumarate, Opera_ID_399, AC1NQXZ5, (y)-Brompheniramine maleate, brompheniramine; maleic acid, (?)-Brompheniramine maleate, SCHEMBL41913, MLS001148196, 86-22-6 (Parent), SPECTRUM1503985, 980-71-2 (maleate), (+/-)-Brompheniramine maleate, Brompheniramine maleate (USAN), (+)-2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate, (-)-2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate, Bioompheniramine hydrogen maleate, CHEMBL1200961, DTXSID2052657, (A+/-)-Brompheniramine maleate, (+)-2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate (1:1), (S)-2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridinium (Z)-maleate (1:1), MolPort-003-666-520, Pyridine, 2-(p-bromo-alpha-(2-(dimethylamino)ethyl)benzyl)-, maleate (1:1), (-)-, Pyridine, 2-(p-bromo-alpha-(2-(dimethylamino)ethyl)benzyl)-, maleate (1:1), (S)-, BCPP000315, HMS1569O12, HMS1922O16, HMS2093O07, HMS2096O12, HMS2230I21, HMS2234D14, HMS3260J03, HMS3713O12, Pharmakon1600-01503985, 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (S)-, (Z)-2-butenedioate (1:1), HY-B0480, Tox21_500201, CCG-39068, NSC758652, s2585, AKOS015855858, AC-1311, BCP9000453, CS-2595, LP00201, NSC-758652, NCGC00093676-01, NCGC00093676-02, NCGC00093676-03, NCGC00093676-04, NCGC00093676-05, NCGC00260886-01, AN-15069, AS-14101, BC214875, SMR000653459, BCP0726000240, AB2000679, LS-130306, LS-130307, LS-130309, LS-130310, EU-0100201, B 2390, D00663, ( inverted question mark)-Brompheniramine maleate, SR-01000003057-2, SR-01000003057-4, SR-01000003057-5, SR-01000003057-8, 2- p-Bromo-a-2-(dimethylamino)ethylbenzylpyridine maleate, 2-(p-bromo-alpha-(2-dimethylaminoethyl)benzyl)pyridine maleate, Brompheniramine Maleate 1.0 mg/ml in Methanol (as free base), 1-(p-bromophenyl)-1-(2-pyridyl)-3-dimethylaminopropane maleate, 3-(p-bromophenyl)-3-(2-pyridyl)-N,N-dimethylpropylamine maleate, 3-(4-bromophenyl)-N,N-dimethyl-3-(2-pyridinyl)-1-propanamine maleate, 3-(4-bromophenyl)-N,N-dimethyl-3-(2-pyridyl)propan-1-amine; maleic acid, Brompheniramine maleate, United States Pharmacopeia (USP) Reference Standard, 3-(4-bromophenyl)-N,N-dimethyl-3-(pyridin-2-yl)propan-1-amine (2Z)-but-2-enedioate, 3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine; (Z)-but-2-enedioic acid, Brompheniramine Maleate, Pharmaceutical Secondary Standard; Certified Reference Material, 32865-01-3, 8055-73-0


ID: 2125

chemical graph of compound 2125



InChIKey: SRJOCJYGOFTFLH-UHFFFAOYSA-N
SMILES: C1CNCCC1C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3773
synonyms found at PubChem are:
Isonipecotic acid, Piperidine-4-carboxylic acid, 498-94-2, 4-Piperidinecarboxylic acid, 4-Carboxypiperidine, Hexahydroisonicotinic acid, dl-isopipecolinic acid, Isonicotinic acid, hexahydro-, h-inp-oh, Acide isonipecotique, 4-Hexahydroisonicotinic acid, NSC 61049, UNII-M5TZP1RWIE, iso-nipecotic acid, Acide isonipecotique [French], Acide piperidine-carboxylique-4, h-pic(4)-oh, M5TZP1RWIE, EINECS 207-872-3, BRN 0112553, 4-Piperidine carboxylic acid, Acide piperidine-carboxylique-4 [French], CHEMBL279998, SRJOCJYGOFTFLH-UHFFFAOYSA-N, isonipecotic acid (piperidine-4-carboxylic acid), 4-Piperidinecarboxylic acid; Hexahydroisonicotinic acid, isonipecolinic acid, 4-carboxy-piperidine, PubChem7718, INP-OH, ACMC-1AHKL, AC1L1GOH, Isonipecotic acid, 97%, H-DL-INP-OH, Lopac-I18008, 4-piperidincarboxylic acid, D0AC2H, D0L6EM, 4-piperidinylcarboxylic acid, Piperidin-4-carboxylic acid, Lopac0_000705, MLS000069407, Piperidinecarboxylic acid-(4), SCHEMBL104297, AC1Q74O2, GTPL4227, DTXSID9060100, CTK1D6355, MolPort-000-145-904, HMS3262M11, ZINC156973, ACT02073, CS-D1472, KS-000000PX, NSC61049, Tox21_500705, AB2970, ANW-30868, BBL005463, BDBM50000106, FC1298, MFCD00006004, NSC-61049, SBB004231, STK498304, AKOS000118858, AB00566, CCG-204790, LP00705, LS20782, MCULE-7477545245, PS-5850, RP00909, RTC-010227, TRA0085282, TRA0089230, NCGC00015573-01, NCGC00015573-02, NCGC00015573-03, NCGC00015573-04, NCGC00015573-05, NCGC00093373-02, NCGC00093373-03, NCGC00261390-01, AC-22478, AJ-13925, AN-45340, BC202249, BR-47605, KB-59750, LS-85056, SC-04843, SMR000059085, SY001425, TL806100, AB1002739, DB-014830, AM20100215, C3382, EU-0100705, FT-0602398, I0256, ST24033220, ST50213929, A16063, B-8175, I18008, Piperidine-4-carboxylic acid(isonipecotic acid), 65148-EP2281823A2, 65148-EP2305660A1, 65148-EP2308812A2, 65148-EP2308869A1, Piperidine-4-carboxylic acid (Isonipecotic acid), SR-01000075617, I12-0039, SR-01000075617-1, W-106001, I14-23645, F2191-0187, AC1OC3FP, piperidin-1-ium-4-carboxylate, CJ-01564, ZB006493


ID: 2126

chemical graph of compound 2126



InChIKey: SRVVUYIJVBLEJI-UHFFFAOYSA-N
SMILES: CC1=C(C=CC(=C1)C2=NOC(=N2)C)C3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)OC)N5CCN(CC5)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 11497466
synonyms found at PubChem are:
GR 127935 hydrochloride, GR127935 hydrochloride, 148642-42-6, GR 127935 hydrochloride hydrate, CHEBI:64111, N-[4-Methoxy-3-(4-methyl-1-piperazinyl)phenyl]-2'-methyl-4'-(5-methyl-1,2,4-oxadiazol-3-yl)-1,1'-biphenyl-4-carboxamide hydrochloride, N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-2'-methyl-4'-(5-methyl-1,2,4-oxadiazol-3-yl)biphenyl-4-carboxamide hydrochloride, MLS002153332, 4-[2-methoxy-5-({[2'-methyl-4'-(5-methyl-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]carbonyl}amino)phenyl]-1-methylpiperazin-1-ium chloride, SR-01000076115, SMR001230745, EU-0100790, GR-127935 hydrochloride, SCHEMBL6017123, CHEMBL1256656, DTXSID0042587, MolPort-023-276-117, BCP19014, Tox21_500790, ABP001016, AKOS024456623, CCG-222094, LP00790, NCGC00094125-01, NCGC00261475-01, B6754, G 5793, J-008498, SR-01000076115-1, SR-01000076115-3


ID: 2127

chemical graph of compound 2127



InChIKey: SRWHWJLUDSYHLO-LUKAEVKMSA-N
SMILES: C[C@@]12CCC3[C@]4(C=CC(=O)C(C4CC(=O)[C@]3(C1=CC(=O)O[C@H]2C5=COC=C5)C)(C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6708577
synonyms found at PubChem are:
SPBio_000066, Spectrum_000650, SpecPlus_000161, Spectrum2_000253, Spectrum3_000042, Spectrum4_001324, Spectrum5_000167, AC1O8FE2, BSPBio_001763, KBioGR_001787, KBioSS_001130, DivK1c_006257, SCHEMBL12998455, KBio1_001201, KBio2_001130, KBio2_003698, KBio2_006266, KBio3_000923, CCG-39814, 7-DEACETOXY-7-OXODEOXYGEDUNIN, NCGC00179027-01, BRD-A37523642-001-02-5, (1R,4bR,10aS,12aR)-1-(furan-3-yl)-4b,7,7,10a,12a-pentamethyl-1,6,6a,10b,11,12-hexahydronaphtho[2,1-f]isochromene-3,5,8-trione


ID: 2128

chemical graph of compound 2128



InChIKey: SRZNHPXWXCNNDU-RHBCBLIFSA-N
SMILES: CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@](C3=O)(NC(=O)C4SC(=C(C(=O)N)C(=O)O)S4)OC)SC2)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 53025
synonyms found at PubChem are:
cefotetan, 69712-56-7, Cefotetanum, Apacef, ICI 156834, MLS002153829, CHEBI:3499, Cefotetanum [INN-Latin], (6R,7S)-7-({[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl]carbonyl}amino)-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, SMR001233197, Cefotan (TN), ICI-156834, (6R,7S)-7-(4-(Carbamoylcarboxymethylene)-1,3-dithiethane-2-carboxamido)-7-methoxy-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7beta-({[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl]carbonyl}amino)-7alpha-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-3,4-didehydrocepham-4-carboxylic acid, W-104601, C17H17N7O8S4, EINECS 274-093-3, BRN 1208088, ICI 156,834, (6R,7S)-7-(4-(carbamoylcarboxymethylene)-1,3-dithiethane-2-carboxamido)-7-methoxy-3-(((1-methyl-1H-tetrazol-5- yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2- carboxylic acid, (6R,7S)-7-[[4-(1-amino-3-hydroxy-1,3-dioxopropan-2-ylidene)-1,3-dithietane-2-carbonyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, UNII-48SPP0PA9Q, Cefotetan [USAN:USP:INN:BAN], NCGC00016914-01, (6R,7S)-4-((2-Carboxy-7-methoxy-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-en-7-yl)carbamoyl)-1,3-dithietane-delta(sup 2,alpha)-malonamic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl)carbonyl)amino)-7-methoxy-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-, (6R-(6alpha,7alpha))-, Cefotetan free acid, Apatef (TN), CAS-69712-56-7, Prestwick0_000473, Prestwick1_000473, Prestwick2_000473, Prestwick3_000473, DSSTox_CID_2762, D0AP9T, 48SPP0PA9Q, DSSTox_RID_76720, DSSTox_GSID_22762, SCHEMBL61376, BSPBio_000606, cid_53025, SPBio_002545, Cefotetan (JP15/USP/INN), Cefotetan (JP17/USP/INN), AC1L1E33, BPBio1_000668, CHEMBL474579, DTXSID1022762, BDBM80643, MolPort-005-935-573, ZX-AFC002959, HMS1569O08, HMS2096O08, HMS2234C15, HMS3713O08, BCP10745, ZINC3830441, Tox21_110681, AKOS015896100, AC-2141, CCG-220473, DB01330, 74356-00-6 (di-hydrochloride salt), NCGC00179507-01, CC-25578, KB-277446, AB00513847, FT-0603035, A-8477, C06886, D00260, Cefotetan, Antibiotic for Culture Media Use Only, 712C567, C-23677, SR-01000842155, I06-1743, SR-01000842155-3, (6R,7S)-7-(4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietane-2-carboxamido)-7-methoxy-3-((1-methyl-1H-tetrazol-5-ylthio)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl]-oxomethyl]amino]-7-methoxy-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[[4-(2-Amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl]carbonyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid, (6R,7S)-7-[[4-(1-carbamoyl-2-hydroxy-2-oxo-ethylidene)1,3-dithietane-2-carbonyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[4-(2-amino-1-carboxy-2-keto-ethylidene)-1,3-dithietane-2-carbonyl]amino]-8-keto-7-methoxy-3-[[(1-methyltetrazol-5-yl)thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietane-2-carbonyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[4-[1-azanyl-3-oxidanyl-1,3-bis(oxidanylidene)propan-2-ylidene]-1,3-dithietan-2-yl]carbonylamino]-7-methoxy-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid


ID: 2129

chemical graph of compound 2129



InChIKey: SSAJNPNVUYMUCI-UHFFFAOYSA-N
SMILES: CCN(CC)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 18542
synonyms found at PubChem are:
Dubimax, Dusodril, Gevatran, Praxilene, Iridus, Nafronyl acid oxalate, Naphtidrofuryl oxalate, Nafronyl oxalate [USAN], EINECS 221-703-0, NSC 225233, LS 121, EU-1806, 2-(Diethylamino)ethyl tetrahydro-alpha-(1-naphthylmethyl)-2-furanpropionate oxalate (1:1), 2-Furanpropanoic acid, tetrahydro-alpha-(1-naphthalenylmethyl)-, 2-(diethylamino)ethyl ester, ethanedioate (1:1), 2-Furanpropionic acid, tetrahydro-alpha-(1-naphthylmethyl)-, 2-(diethylamino)ethyl ester, oxalate (1:1), Diethyl(2-(2-(1-naphthylmethyl)-3-(tetrahydro-2-furyl)propionyloxy)ethyl)ammonium hydrogen oxalate, LS-121, AC1L2CA6, C24H33NO3.C2H2O4, MolPort-000-815-884, MCULE-2856913118, LS-70565, 2-Furanpropionic acid, tetrahydro-alpha-(1-naphthylmethyl)-, 2-(diethylamino)ethyl ester,oxalate (1:1), 26263-44-5, diethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium; 2-hydroxy-2-oxoacetate, Nafronyl oxalate, 3200-06-4, Naftidrofuryl oxalate, Nafronyl oxalate salt, Naftidrofuryl (oxalate), 2-(Diethylamino)ethyl 3-(naphthalen-1-yl)-2-((tetrahydrofuran-2-yl)methyl)propanoate oxalate, DSSTox_CID_25533, DSSTox_RID_80935, DSSTox_GSID_45533, naftidrofuryl hydrogen oxalate, alpha-[1-Naphthylmethyl]-2-tetrahydrofuranpropionic acid diethylaminoethyl ester, CHEMBL1439099, Nafronyl oxalate salt, analytical standard, SMR000539007, CAS-3200-06-4, NSC225233, SR-01000789261, Clarantin, 2-(diethylamino)ethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate;oxalic acid, Naftidrofuryloxalate, Praxilene (TN), Prestwick_696, Naftidrofuryl(oxalate), 2-(Diethylamino)ethyl tetrahydro-.alpha.-(1-naphthylmethyl)-2-furanpropionate oxalate (1:1), AC1L7MCR, naftidrofuryl; oxalic acid, NCGC00016982-01, MLS000766889, MLS001032044, MLS001173344, MLS002222244, SCHEMBL123848, SPECTRUM1503419, DTXSID6045533, CTK8C4926, HMS501A20, KS-00001FAU, MolPort-003-666-484, HMS1569K15, HMS1922C14, HMS2093E15, HMS2096K15, HMS2875A08, HMS3713K15, Pharmakon1600-01503419, BCP19865, HY-B1107, Tox21_110724, ANW-73527, CCG-40305, NSC758462, AKOS015960731, Tox21_110724_1, API0006883, CS-4704, NSC-225233, NSC-758462, NCGC00095050-01, NCGC00095050-02, NCGC00178213-05, 4,4-Diaminostilbene-2,3-Disulfonic Acid, AC-12093, O219, KB-224003, ST2409387, TC-162272, FT-0629863, D05107, C-54995, J-018595, SR-01000789261-2, SR-01000789261-3, 2-Furanpropionic acid, 2-(diethylamino)ethyl ester oxalate (1:1), 2-Furanpropionic acid, 2-(diethylamino)ethyl esteroxalate (1:1), 2-Furanpropanoic acid, 2-(diethylamino)ethyl ester, ethanedioate (1:1), 2-(diethylamino)ethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate,oxalic acid, 2-diethylaminoethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate; oxalic acid


ID: 2130

chemical graph of compound 2130



InChIKey: SSKFWBSXNIWCBH-VCHYOVAHSA-N
SMILES: C1CN(CCN1/C=C/CC2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5353532
synonyms found at PubChem are:
cinnarazine, AC1NS4AP, Spectrum5_001056, BSPBio_002339, SPECTRUM1503204, SCHEMBL7860447, CHEMBL1370236, HMS502H10, CHEBI:109557, HMS1922I05, HMS2092N08, Pharmakon1600-01503204, CCG-39309, NSC758400, NSC-758400, IDI1_000788, NCGC00095014-01, NCGC00095014-02, NCGC00095014-03, SBI-0051784.P002, AB00052324_02, SR-05000001831, SR-05000001831-1, 1-benzhydryl-4-[(E)-3-phenylprop-1-enyl]piperazine, BRD-K32256916-001-02-4, BRD-K32256916-001-03-2


ID: 2131

chemical graph of compound 2131



InChIKey: SSMIFVHARFVINF-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=CC3=C2C(=C1)C(=O)NC3=O)N

biological descriptors:

CFTR relevance: PARP-1 inhibitor

Category:
Influence on CFTR function enhances CFTR function
Order of interaction indirect
subcellular compartment Nucleus (Transcription)

reference list:

"P Lesimple" "R Phillipe" "GW Carlile" "J Goepp" "HM Sampson" "F Ciciriello" "SM Anjos" "H Balghi" "J Liao" "D Waller" "F Dantzer" "P Ferraro" "R Robert" "JW Hanrahan" "DY Thomas" "DL Zhang"
"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 1720
synonyms found at PubChem are:
4-Amino-1,8-naphthalimide, 1742-95-6, 4-Aminonaphthalimide, 6-AMINO-BENZO[DE]ISOQUINOLINE-1,3-DIONE, 6-Amino-1H-benzo[de]isoquinoline-1,3(2H)-dione, 4-Aminonaphthalene-1,8-dicarboximide, Naphthalimide, 4-amino-, DFP 1, 1H-Benz[de]isoquinoline-1,3(2H)-dione, 6-amino-, EINECS 217-110-1, 6-aminobenzo[de]isoquinoline-1,3-dione, BRN 0177185, PARP Inhibitor V, 4-ANI, CHEMBL338790, CHEBI:40071, SSMIFVHARFVINF-UHFFFAOYSA-N, 4-AMINO-1,8 NAPHTHALIMIDE, 6-Amino-1H-benz(de)isoquinoline-1,3(2H)-dione, 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6-amino-, 4AN, 2pax, AC1Q6JKU, Lopac-A-0966, D03JTS, D09VUP, 4-ANI, Lopac0_000063, SCHEMBL21124, BSPBio_001430, KBioGR_000150, KBioSS_000150, 4-22-00-06603 (Beilstein Handbook Reference), AC1L1C36, ZINC8558, DTXSID6061941, BCBcMAP01_000231, BDBM27498, CTK8F5667, KBio2_000150, KBio2_002718, KBio2_005286, KBio3_000299, KBio3_000300, MolPort-002-499-717, Bio1_000370, Bio1_000859, Bio1_001348, Bio2_000150, Bio2_000630, HMS1361H12, HMS1791H12, HMS1989H12, HMS3260M07, HMS3402H12, BB_SC-07136, 4-Amino-1,8-naphthalimide, 96%, Tox21_500063, BBL027625, MFCD00006921, SBB003425, STK934866, AKOS005664748, AC-6718, CCG-204158, DB07096, LP00063, MCULE-5608953652, IDI1_033900, NCGC00015035-01, NCGC00015035-02, NCGC00015035-03, NCGC00015035-04, NCGC00015035-05, NCGC00015035-06, NCGC00015035-07, NCGC00093577-01, NCGC00093577-02, NCGC00093577-03, NCGC00093577-04, NCGC00093577-05, NCGC00260748-01, AJ-08314, AN-20710, AS-35824, CC-17680, LS-33496, ZB000667, AX8093535, A8840, EU-0100063, FT-0633814, ST50825610, A 0966, A-2606, 6-amino-1H-benz[de]-isoquinoline-1,3(2H)-dione, 7-Amino-3-hydroxy-1H-benzo[de]isoquinolin-1-one, C-30851, SR-01000075200, J-010976, SR-01000075200-1, 6-Amino-1H-benzo[de]isoquinoline-1,3(2H)-dione #, BRD-K50214219-001-02-4, I14-18437, 10-amino-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(13),5,7,9,11-pentaene-2,4-dione, 4-aminonaphthalene-1,8-dicarboxylic anhydride;6-Aminobenz[de]isochromene-1,3-dione


ID: 2132

chemical graph of compound 2132



InChIKey: SSOXZAQUVINQSA-BTJKTKAUSA-N
SMILES: CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5282139
synonyms found at PubChem are:
PHENIRAMINE MALEATE, 132-20-7, Inhiston, Trimetose, Daneral, Naphcon a, Avil-retard, Pheniramine hydrogen maleate, Pheniramine (Maleate), Pheniramine maleate salt, Prophenpyridamine maleate, PM 241, CCRIS 6265, EINECS 205-051-4, HO 11513, 1-Phenyl-1-(2-pyridyl)-3-dimethylaminopropane maleate, CHEBI:31990, 2-(alpha-(2-(Dimethylamino)ethyl)benzyl)pyridine, maleate, 2-(alpha-(2-(Dimethylamino)ethyl)benzyl)pyridine, bimaleate, Phenyl(2-pyridyl)(beta-N,N-dimethylaminomethyl) methane maleate, 1-(N,N-Dimethylamino)-3-(phenyl-3-alpha-pyridyl)propane maleate, 2-Pyridinepropanamine, N,N-dimethyl-gamma-phenyl-, (Z)-2-butenedioate (1:1), 2-(alpha-(2-Dimethylaminoethyl)benzyl)pyridine bimaleate, N,N-Dimethyl-3-phenyl-3-(2-pyridyl)propylamine hydrogen maleate, Pyridine, 2-(alpha-(2-(dimethylamino)ethyl)benzyl)-, maleate (1:1), (2Z)-but-2-enedioic acid; dimethyl[3-phenyl-3-(pyridin-2-yl)propyl]amine, 2-Pyridinepropanamine, N,N-dimethyl-gamma-phenyl-, (2Z)-2-butenedioate (1:1), SR-01000075263, Pheniramine maleate [USAN], Antolozine, Fervex, Pheniramine maleate [USAN:USP], (Z)-but-2-enedioic acid;N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine, C16H20N2.C4H4O4, Prestwick_769, AC1NQZJE, CHEMBL1653, SCHEMBL25318, MLS001148181, 86-21-5 (Parent), SPECTRUM1500478, AC1Q71E7, Pheniramine maleate (JAN/USP), HMS500L17, MolPort-003-666-259, HMS1568K19, HMS1920F22, HMS2091P04, HMS2095K19, HMS2232I20, HMS3263E03, HMS3712K19, Pharmakon1600-01500478, HY-B0971, Tox21_500981, CCG-39109, LS-753, MFCD00079250, NSC757270, AKOS026749878, CS-4460, LP00981, NSC-757270, NCGC00094281-01, NCGC00094281-02, NCGC00094281-03, NCGC00094281-04, NCGC00094281-05, NCGC00261666-01, AS-12971, SMR000653458, EU-0100981, P2271, S4045, C12574, D01174, P 6902, I14-6763, J-006144, SR-01000075263-1, SR-01000075263-4, SR-01000075263-7, 2-[|A-[2-(Dimethylamino)ethyl]benzyl]pyridine Maleate, PHENIRAMINE MALEATE (SEE ALSOPHENIRAMINE 86-21-5), N,N-Dimethyl-|A-phenyl-2-pyridinepropanamine (2Z)-2-Butenedioate, Pheniramine maleate, European Pharmacopoeia (EP) Reference Standard, Pheniramine maleate, United States Pharmacopeia (USP) Reference Standard, (Z)-but-2-enedioic acid; N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine, 155683-11-7, DSSTox_CID_5866, DSSTox_RID_77955, DSSTox_GSID_25866, Pheniramine maleate2-[3-(dimethylammonio)-1-phenylpropyl]pyridinium (2Z)-but-2-enedioate, DTXSID0025866, Tox21_111188, Tox21_201074, Tox21_111188_1, NCGC00015831-06, NCGC00258627-01, A806397, (Z)-2-butenedioate; dimethyl-[3-phenyl-3-(2-pyridin-1-iumyl)propyl]ammonium, (Z)-but-2-enedioate; dimethyl-(3-phenyl-3-pyridin-1-ium-2-yl-propyl)azanium


ID: 2133

chemical graph of compound 2133



InChIKey: SSRCYGATNWFTBJ-UHFFFAOYSA-N
SMILES: COC1=CC(=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5781145
synonyms found at PubChem are:
2'-methoxyformononetin, 2'-METHOXYFORMONETIN, KBio2_001217, AC1NXHQP, Spectrum_000737, SpecPlus_000117, Spectrum2_000188, Spectrum3_000212, Spectrum4_001614, Spectrum5_000367, BSPBio_001823, KBioGR_001987, KBioSS_001217, SPECTRUM201310, DivK1c_006213, SCHEMBL234355, SPBio_000115, CHEMBL1087126, KBio1_001157, KBio2_003785, KBio2_006353, KBio3_001323, SSRCYGATNWFTBJ-UHFFFAOYSA-N, CCG-38396, SDCCGMLS-0066420.P001, NCGC00095503-01, NCGC00095503-02, NCGC00178978-01, 3-(2,4-dimethoxyphenyl)-7-hydroxychromen-4-one, 3-(2,4-dimethoxy-phenyl)-7-hydroxy-chromen-4-one, BRD-K84390227-001-02-2, BRD-K84390227-001-03-0, 3-(2,4-Dimethoxyphenyl)-7-hydroxy-4H-1-benzopyran-4-one


ID: 2134

chemical graph of compound 2134



InChIKey: SSTXWOBEGIONBB-UHFFFAOYSA-N
SMILES: CC1=C2C(=C3C=CC(=CC3=N2)OC)CCN1.O.O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6097179
synonyms found at PubChem are:
Harmaline hydrochloride dihydrate, 6027-98-1, UNII-5B4DGH2M9R, 5B4DGH2M9R, CCRIS 7891, 63885-08-5, HARMALINE, HYDROCHLORIDE, DIHYDRATE, 7-methoxy-1-methyl-3,4-dihydrobeta-carboline, chloride, hydrate, hydrate, Prestwick_251, 1-Methyl-7-methoxy-3,4-dihydro-beta-carboline hydrochloride, AC1O1IIS, CHEMBL1494278, HMS1569J22, MFCD00150052, AKOS027382834, API0008352, NCGC00017054-01, Harmaline hydrochloride dihydrate, >=95%, KB-77673, ST081355, CAS-6027-98-1, FT-0635945, ST50309261, 1-Methyl-7-methoxy-3,4-dihydro-|A-carboline hydrochloride, 7-methoxy-1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole dihydrate hydrochloride, 7-Methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole hydrochloride dihydrate


ID: 2135

chemical graph of compound 2135



InChIKey: STTADZBLEUMJRG-IKNOHUQMSA-N
SMILES: CN1CC[C@@]23CCCC[C@@H]2[C@@H]1CC4=C3C=C(C=C4)OC.O.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5462351
synonyms found at PubChem are:
Dextromethorphan hydrobromide monohydrate, 6700-34-1, Dextromethorphan hydrobromide, Methorate, Drixoral Cough, PediaCare 1, Dextromethorphan hydrobromide hydrate, Benylin DM, Dextromethorphan (hydrobromide hydrate), Hold, St. Joseph Cough Syrup, Chloraseptic DM, UNII-9D2RTI9KYH, Romilar, Tylenol Cough Liquid, Endotussin-NN Pediatric, Robitussin Cough Calmers, 9D2RTI9KYH, Robitussin Pediatric Cough, Dextromethorphan hydrobromide OROS Tablets, Drixoral Cough & Sore Throat, Robitussin Maximum Strength Cough, d-3-Methoxy-N-methylmorphinan hydrobromide, Dextromethorphan Hydrobromide, Monohydrate, Dextromethorphan HBr, 3-Methoxy-17-methyl-9alpha,13alpha,14alpha-morphinan hydrobromide monohydrate, d-3-Methoxy-N-methylmorphinan hydrobromide monohydrate, (9S,13S,14S)-3-Methoxy-17-methylmorphinan hydrobromide, 125-71-3 (Parent), Morphinan, 3-methoxy-17-methyl-, (9alpha,13alpha,14alpha)-, hydrobromide, monohydrate, SMR000326694, Prestwick_686, Benylin DM (TN), Dextromethorphan hydrobromide [BAN:JAN], C18H25NO.HBr.H2O, (9?,13?,14?)-3-Methoxy-17-methylmorphinan hydrobromide monohydrate, NCGC00017066-01, CAS-6700-34-1, Dextromethorphan+quinidine, Dextromethorphan hydrobromide [USP:BAN:JAN], D0J8RR, C18H25NO.HCl, Dextromethorphan hydrobromicum, MLS000758303, MLS001056752, MLS001401442, MLS002153263, MLS002207070, SCHEMBL121923, CHEMBL1256818, S4617 Dextromethorphan hydrobrom, STTADZBLEUMJRG-IKNOHUQMSA-N, HMS1569G19, BCP06073, Dextromethorphan hydrobromide (USP), HY-B1333, CD0144, MFCD02173901, s4617, AKOS015915877, API0002199, CCG-100762, CS-4457, Dextromethorphan HydrobromideMonohydrate, NC00012, NCGC00017066-02, CPD000326694, SAM001247062, LS-176564, Dextromethorphan hydrobromide hydrate (JP17), FT-0636242, ST24046434, X3585, D00848, C-21122, I14-54102, (+)-3-Methoxy-N-methylmorphinan Hydrobromide Monohydrate, Dextromethorphan hydrobromide monohydrate, >=99% (TLC), Dextromethorphan hydrobromide, meets USP testing specifications, 3-Methoxy-17-methyl-9|A,13|A,14|A-morphinan Hydrobromide Hydrate, (9|A,13|A,14|A)-3-Methoxy-17-methylmorphinan Hydrobromide Hydrate, Dextromethorphan hydrobromide monohydrate, tested according to Ph.Eur., Dextromethorphan HBr, Pharmaceutical Secondary Standard; Certified Reference Material, Dextromethorphan Hydrobromide Monohydrate 1.0 mg/ml in Methanol (as anhydrous free base), Dextromethorphan hydrobromide, European Pharmacopoeia (EP) Reference Standard, Dextromethorphan hydrobromide, United States Pharmacopeia (USP) Reference Standard


ID: 2136

chemical graph of compound 2136



InChIKey: STVVMTBJNDTZBF-VIFPVBQESA-N
SMILES: C1=CC=C(C=C1)C[C@@H](CO)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 447213
synonyms found at PubChem are:
L-Phenylalaninol, 3182-95-4, (S)-2-amino-3-phenylpropan-1-ol, (S)-2-Amino-3-phenyl-1-propanol, (S)-(-)-2-Amino-3-phenyl-1-propanol, H-Phenylalaninol, (2S)-2-amino-3-phenylpropan-1-ol, Phenylalaninol, (-)-l-phenylalaninol, l-phenyl alaninol, h-phe-ol, (s)-phenylalaninol, (s)-(-)-phenylalaninol, CHEMBL1235287, STVVMTBJNDTZBF-VIFPVBQESA-N, MFCD00004732, (s)-(-)-2-amino-3-phenyl-propanol, L(-)-2-Amino-3-Phenyl-1-Propanol, l-(-)-phenylalaninol, HPH, D-2-PHENYLALANINOL, 2-Amino-3-phenyl-1-propanol #, l-benzylglycinol, L-Phenylalanoil, 1-phenylalaninol, l-2-phenylalaninol, (L)-phenylalaninol, (-)-phenylalaninol, zlchem 565, L(-)-Phenylalaninol, l-(s)-phenylalaninol, PubChem5724, Benzenepropanol, .beta.-amino-, (S)-, AC1L9KLG, Spectrum2_000830, Spectrum3_001978, PHENYLALANINOL GROUP, D03TUX, AC1Q4UB5, SCHEMBL81769, BSPBio_003578, KSC491Q3N, MLS002207066, SPECTRUM1505339, SPBio_000759, GTPL4752, Jsp005915, CTK3J1836, KBio3_002959, ZLC0430, MolPort-001-794-232, 2-(S)-amino-3-phenyl-1-propanol, ACT02363, BCP17030, CS-D1142, ZINC6731693, (1S)-1-Benzyl-2-hydroxyethylamine, ANW-27208, BDBM50367058, CCG-40282, FC1218, RW1866, (2S)-2-amino-3-phenyl-1-propanol, (S)-2-amino-3-phenyl-propan-1-ol, AKOS005259774, AC-5650, DB04484, RTC-062187, (S)(-)-2-amino-3-phenyl-1-propanol, KS-0000024M, (S)-1-hydroxymethyl-2-phenyl-ethylamine, D-(+)-2-Amino-3-phenyl-1-propanol?, NCGC00177983-01, AC-16295, AC-22383, AJ-56752, BP-20243, KB-15842, KB-79975, SC-03394, SMR001306708, TS-01999, (S)-(-)-2-arnino-3-phenyl-1-propanol, AB0066057, AB1000213, DB-016162, ST2408301, TC-062187, AM20040161, BB 0262987, FT-0082699, FT-0605249, P1028, 67P641, A-2109, P-3550, P-3551, J-520201, BRD-K44204252-001-02-2, BRD-K44204252-001-04-8, Z1741982891, (S)-(-)-2-Amino-3-phenyl-1-propanol, 98%, optical purity ee: 99% (HPLC)


ID: 2137

chemical graph of compound 2137



InChIKey: SUBDBMMJDZJVOS-UHFFFAOYSA-N
SMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 4594
synonyms found at PubChem are:
omeprazole, 73590-58-6, Losec, Prilosec, Antra, Esomeprazole, Omeprazon, Audazol, Omapren, Omepral, Parizac, Zegerid, Mopral, Miol, Belmazol, Ceprandal, Dizprazol, Dudencer, Emeproton, Epirazole, Gastrimut, Gastroloc, Gibancer, Indurgan, Inhibitron, Inhipump, Logastric, Pepticum, Peptilcer, Prazidec, Sanamidol, Secrepina, Ulcometion, Mepral, Miracid, Omeprol, Omezol, Omisec, Omizac, Ompanyt, Ozoken, Prysma, Ramezol, Ulceral, Ulcesep, Ulcozol, Zefxon, Zoltum, Desec, Elgam, Lomac, Ulsen, Ultop, Zimor, Ocid, Omed, Omid, OMEP, Demeprazol, Nopramin, Omeprazol, Omezolan, Paprazol, Pepticus, Prazentol, Prazolit, Procelac, Regulacid, Danlox, Erbolin, Lensor, Morecon, Nilsec, Olexin, Omegast, Omesek, Ortanol, Osiren, Proclor, Result, Ulcsep, Victrix, Zepral, Exter, Gasec, Ulzol, Omebeta 20, Tedec Ulceral, AULCER, Antra MUPS, Omeprazolum, Omez, Prilosec OTC, Omepradex, Omerprazole, Nexium IV, H 168/68, Omeprazol [INN-Spanish], Omeprazolum [INN-Latin], Esomperazole, Gastrogard, Nuclosina, Emilok, r-omeprazole, Omeprazole magnesium, ( -)-Omeprazole, Omeprazone, Omesec, Omeprazole delayed-release, Prilosec (TN), Prestwick_808, OMEPRAZOLE SODIUM, CCRIS 7099, OMZ, CHEBI:77260, HSDB 3575, Esomeprazole sodium salt, Omeprazole [USAN:INN:BAN:JAN], 5-Methoxy-2-(((4-methoxy-3,5-dimethyl-2-pyridyl)methyl)sulfinyl)benzimidazole, Nexium, H-168/68, CHEMBL1503, Nexiam, 1H-Benzimidazole, 5-methoxy-2-(((4-methoxy-3,5-dimethyl-2-pyridinyl)methyl)sulfinyl)-, 5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazole, 5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole, 5-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfinyl}-1H-benzimidazole, MLS000069373, SAN-15, C17H19N3O3S, AGI-010, SUBDBMMJDZJVOS-UHFFFAOYSA-N, (+)-omeprazole, H 168-68, 2-(((3,5-Dimethyl-4-methoxy-2-pyridyl)methyl)sulfinyl)-5-methoxy-1H-benzimidazole, DM-3458, NCGC00016925-06, SMR000058847, CAS-73590-58-6, Esomeprazole Sodium, O0359, DSSTox_CID_1080, 5-Methoxy-2[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole, 2-({[3,5-dimethyl-4-(methyloxy)pyridin-2-yl]methyl}sulfinyl)-5-(methyloxy)-1H-benzimidazole, 6-methoxy-2-(((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)sulfinyl)-1H-benzo[d]imidazole, DSSTox_RID_75929, UNII-S51HU491WJ, DSSTox_GSID_21080, Omebeta, Olit, Omeprazen, 5-methoxy-2-((4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl)-1H-benzo[d]imidazole, 5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole, 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole, (R)-Esomeprazole, (+-)-Omeprazole, Omeprazole, (R)-, Omeprazole (JAN/USP/INN), SR-01000003003, R-Omeprazole [USP-RS], S51HU491WJ, Omperazole, 161796-78-7, Omeprazole, solid, 5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole, 6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole, Omeprazole Pellets, Omeprazole,(S), Losec (TN), Losec, Omesec, Prilosec, Zegerid, Omeprazole, Omeprazole [USAN:USP:INN:BAN:JAN], (s)-omeprazole sodium, Omeprazole (Prilosec), ACMC-20p1du, AC1L1IIJ, Maybridge4_002645, Opera_ID_1863, Prestwick0_000493, Prestwick1_000493, Prestwick2_000493, Prestwick3_000493, (.+/-.)-Omeprazole, Omeprazole, 98% 1g, D01XNB, UPCMLD-DP075, cid_4594, SCHEMBL1191, omeprazole sodium bicarbonate, BSPBio_000385, MLS001076112, MLS001424148, MLS006010400, MLS006011759, BIDD:GT0189, SPBio_002306, BPBio1_000425, GTPL4279, Omeprazole (JP17/USP/INN), Esomeprazole sodium salt hydrate, DTXSID6021080, SCHEMBL11995456, UPCMLD-DP075:001, CHEBI:91766, CTK8I2124, CTK9A5793, MolPort-003-666-741, MolPort-003-849-702, HMS1528I05, HMS1569D07, HMS2052G17, HMS2090E16, HMS2090F11, HMS2096D07, HMS2232B21, HMS3269D17, HMS3394G17, HMS3651A11, HMS3713D07, Pharmakon1600-01505693, (S)-Omeprazole sodium salt hydrate, BCP05852, BCP13592, BCP21299, HY-B0113, KS-000001KH, 2,3,5-Trimethylpyridine/Omeprazole, Tox21_110686, Tox21_200509, AC-401, BBL028172, BDBM50103597, BDBM50241343, CO0037, DL-462, MFCD00083192, NSC751450, NSC759192, s1389, STK623746, 119141-88-7 (base), AKOS005066653, AKOS015895343, Tox21_110686_1, AC-4676, CCG-101130, CCG-213517, CS-1868, DB00338, HS-0055, LS-7629, MCULE-3224208952, NC00380, NE55490, NSC-751450, NSC-759192, 1H-Benzimidazole, 6-methoxy-2-((R)-((4-methoxy-3,5-dimethyl-2-pyridinyl)methyl)sulfinyl)-, IDI1_032523, NCGC00016925-01, NCGC00016925-02, NCGC00016925-03, NCGC00016925-04, NCGC00016925-05, NCGC00016925-07, NCGC00016925-08, NCGC00016925-10, NCGC00016925-11, NCGC00021522-03, NCGC00021522-04, NCGC00021522-05, NCGC00258063-01, Omeprazole, analytical reference material, AN-11759, AN-15878, BC203197, BC226373, CPD000058847, K253, KB-63582, SAM001246900, SC-15162, SBI-0206896.P001, AB0014122, AB1009257, TL8005099, FT-0601585, FT-0652860, FT-0653294, H 199, ST24048844, A19447, C07324, D00455, J10125, 668985-31-7 (Mg), 141O887, A837865, H168/68, I06-0705, SR-01000003003-4, SR-01000003003-7, SR-01000003003-8, 5-methoxy-2-((4-methoxy-3,5-dimethylpyridin-2-yl), BRD-A55962179-001-04-9, BRD-A55962179-001-08-0, BRD-A55962179-001-20-5, BRD-A88691025-001-07-4, I14-40975, F0001-2386, Z1672902589, Omeprazole, European Pharmacopoeia (EP) Reference Standard, Omeprazole, United States Pharmacopeia (USP) Reference Standard, 2-(3-methoxy-2,4-dimethylbenzylsulfinyl)-6-methoxy-1H-benzo[d]imidazole, 5-Methoxy-2-((S)-((4-methoxy-3,5-dimethyl-2- pyridinyl)methyl)sulfinyl)-, Omeprazole, Pharmaceutical Secondary Standard; Certified Reference Material, (+)-5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-sulfinyl]-1h-benzimidazole, (-)-5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-sulfinyl]-1h-benzimidazole, (RS)-5-Methoxy-2-(4-methoxy-3,5-dimethyl-2-pyridylmethylsulphinyl)benzimidazole, 5-methoxy 2-[[(4-methoxy-3,5-dimethyl-2-pyrdinyl)-methyl]sulfinyl]-1H-benzimidazole, 5-methoxy 2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)-methyl]sulfinyl]-1 H-benzimidazole, 5-methoxy 2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)-methyl]sulfinyl]-1H-benzimidazole, 5-methoxy-2-(((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)sulfinyl)-1H-benzo[d]imidazole, 5-methoxy-2-(2-(4-methoxy-3,5-dimethylpyridin-2-yl)ethylsulfinyl)-1H-benzo[d]imidazole, 5-Methoxy-2-(4-methoxy-3,5-dimethyl-pyridin-2-ylmethanesulfinyl)-1H-benzoimidazole, 5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]sulfinyl- 1H-benzimidazole, 5-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-3H-benzoimidazole, 5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methanesulfinyl]-3H-1,3-benzodiazole, 5-Methoxy-2-[(RS)-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfinyl]-1H-benzimidazole, 5-methoxy-2-[[(3,5-dimethyl-4-methoxy-2-pyridyl)methyl]sulfinyl]-1H-benzimidazole, 5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulphinyl]-1H-benzimidazole, 5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]sulfinyl]-benzimidazole, 5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]sulfonyl]benzimidazole, 5-methoxy-2-[[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulphinyl]1H-benzimidazole, 5-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methane]sulfinyl}-1H-1,3-benzodiazole, 6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1H-benzimidazole, 6-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-1H-benzimidazole, 6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)-methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-[[(4-methoxy-3,5dimethyl-2-pyridinyl)-methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-[[(4-methoxy3,5-dimethyl-2-pyridinyl)-methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-[[(4methoxy-3,5-dimethyl2-pyridinyl)methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methane]sulfinyl}-1H-1,3-benzodiazole, Omeprazole for peak identification, European Pharmacopoeia (EP) Reference Standard, Omeprazole solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, (omeprazole)5-Methoxy-2-(4-methoxy-3,5-dimethyl-pyridin-2-ylmethanesulfinyl)-1H-benzoimidazole, (RS)-6-methoxy-2-((4-methoxy-3,5-dimethylpyridin-2-yl) methylsulfinyl)-1H-benzo[d]imidazole, 131959-78-9, 172964-80-6, 177541-02-5, 5-Methoxy-2-(4-methoxy-3,5-dimethyl-pyridin-2-ylmethanesulfinyl)-1H-benzoimidazole (omeprazole), 5-Methoxy-2-(4-methoxy-3,5-dimethyl-pyridin-2-ylmethanesulfinyl)-1H-benzoimidazole(Omeprazole), 5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole; Antra; Losec, 6-Methoxy-2-[(S)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole sodium salt


ID: 2138

chemical graph of compound 2138



InChIKey: SUGXUUGGLDCZKB-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=C(OC2=O)Cl)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 1609
synonyms found at PubChem are:
3,4-dichloroisocoumarin, 51050-59-0, 3,4-Dcl, 1H-2-Benzopyran-1-one,3,4-dichloro-, 3,4-DCI, 3,4 dichloroisocoumarin, 3,4-Dichloro-1H-isochromen-1-one, 3,4-Dichloro-1H-2-benzopyran-1-one, 1H-2-Benzopyran-1-one, 3,4-dichloro-, CHEMBL24983, 3,4-dichloroisochromen-1-one, 3,4-Dichloro-2-benzopyran-1-one, C9H4Cl2O2, Lopac-D-7910, D0F3CA, AC1L1BU9, AC1Q3H9V, cid_1609, Lopac0_000442, BSPBio_001549, KBioGR_000269, KBioSS_000269, MLS002153325, SCHEMBL106901, 3,4-Dichloro-isochromen-1-one, CTK4J3543, KBio2_000269, KBio2_002837, KBio2_005405, KBio3_000537, KBio3_000538, DTXSID70199056, CHEBI:109540, MolPort-003-930-823, SUGXUUGGLDCZKB-UHFFFAOYSA-N, Bio2_000269, Bio2_000749, HMS1361N11, HMS1791N11, HMS1989N11, HMS3261I06, HMS3402N11, ZINC388510, Tox21_500442, BDBM50199883, HSCI1_000089, MFCD00036960, NSC727363, PI-110, 3,4-Dichloro-1H-isochromen-1-one #, CCG-204534, DB04459, LP00442, NSC-727363, IDI1_034019, KS-000019D7, QTL1_000002, NCGC00015369-01, NCGC00015369-02, NCGC00015369-03, NCGC00015369-04, NCGC00015369-05, NCGC00015369-06, NCGC00093859-01, NCGC00093859-02, NCGC00093859-03, NCGC00261127-01, AN-41326, KB-70099, SMR001230738, LS-175220, EU-0100442, D 7910, 3,4-Dichloroisocoumarin serine protease inhibitor, 050D590, 3,4-Dichloroisocoumarin, serine protease inhibitor, SR-01000075831, SR-01000075831-1, BRD-K23704908-001-02-4, BRD-K23704908-001-03-2


ID: 2139

chemical graph of compound 2139



InChIKey: SULYEHHGGXARJS-UHFFFAOYSA-N
SMILES: CC(=O)C1=C(C=C(C=C1)O)O

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MJ Kurth" "LJ Galietta" "MJ Haddadin" "MF Springsteel" "MH Nantz" "K By" "AS Verkman" "M Eda" "EJ Niedzinski"


CID is 6990
synonyms found at PubChem are:
89-84-9, 2',4'-DIHYDROXYACETOPHENONE, 2,4-Dihydroxyacetophenone, 1-(2,4-Dihydroxyphenyl)ethanone, Resacetophenone, 4-Acetylresorcinol, Resoacetophenone, Ethanone, 1-(2,4-dihydroxyphenyl)-, 1-Acetyl-2,4-dihydroxybenzene, Resorcinol, 4-acetyl-, 1-(2,4-dihydroxyphenyl)ethan-1-one, Acetophenone, 2',4'-dihydroxy-, UNII-UC3V356VZC, NSC 10883, .beta.-Resacetophenone, 1-(2,4-dihydroxy-phenyl)-ethanone, EINECS 201-945-3, 4-Acetyl-1,3-benzenediol, 2,4-Dihydroxy Acetophenone, BRN 1282505, UC3V356VZC, 2',4'-Dihydroxy-acetophenone, AI3-00866, CHEMBL243374, CHEBI:18414, SULYEHHGGXARJS-UHFFFAOYSA-N, WLN: QR CQ DV1, 2',4'-Dihydroxyacetophenon, dihydroxyacetophenon, beta-Resacetophenone, 4-Acetyl-Resorcinol, PubChem3375, 2,4-dihyroxyacetophenone, AC1Q1JHT, 2,4-dihydroxy actophenone, 2'4'-dihydroxyacetophenone, 2,4,-dihydroxyacetophenone, 1-Acetylbenzene-2,4-diol, AC1L1NR7, AC1Q5ED3, SCHEMBL26357, 4-08-00-01792 (Beilstein Handbook Reference), KSC448A9T, BIDD:ER0659, ACMC-209r36, 1,3-Dihydroxy-4-acetylbenzene, 2'',4''-dihydroxyacetophenone, 2\',4\'-dihydroxyacetophenone, DTXSID4058998, CTK3E8099, TIMTEC-BB SBB040836, ZINC38028, MolPort-000-482-777, 2,4-DIHYDROOXYACETOPHENONE, AKOS 90593, 1-(2,4-Dihydroxyphenyl)-ethanone, NSC10883, NSC37559, STR03384, AKOS BBS-00004294, UKRORGSYN-BB BBR-007146, 2',4'-Dihydroxyacetophenone, 99%, ANW-39376, BBL012128, BDBM50241221, MFCD00002279, NSC-10883, NSC-37559, SBB040836, STK084318, AKOS000119522, AC-1105, AS01140, CS-W008599, FS-3456, MCULE-8687773185, RL05645, RTC-067541, TRA0025245, 1-(2,4-Dihydroxyphenyl)ethanone, 9CI, KS-00000C03, 4CN-0699, AJ-08777, AN-15263, BC676988, CJ-00226, KB-17586, LS-13469, SC-07232, ST053782, ZB001051, AB0000224, AB1002103, ST2414924, TC-067541, TL8005791, AM20041337, D0561, FT-0610122, C03663, S-1332, I01-2131, W-100356, Z57101026, F1995-0239, 1-Acetyl-2,4-dihydroxybenzene; 4-Acetylresorcinol; Resacetophenone, InChI=1/C8H8O3/c1-5(9)7-3-2-6(10)4-8(7)11/h2-4,10-11H,1H


ID: 2140

chemical graph of compound 2140



InChIKey: SUNSHHXMTAVPFW-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=CC3=CC=CC=[N+]32)O.[Br-]

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MJ Kurth" "LJ Galietta" "MJ Haddadin" "MF Springsteel" "MH Nantz" "K By" "AS Verkman" "M Eda" "EJ Niedzinski"


CID is 10423554
synonyms found at PubChem are:
CHEMBL368363


ID: 2141

chemical graph of compound 2141



InChIKey: SUPBGWCBZUZDOP-KAYWLYCHSA-N
SMILES: COC1=CC(=C2C[C@H]([C@H](OC2=C1)C3=CC(=C(C(=C3)OC)OC)OC)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6708757
synonyms found at PubChem are:
CHEMBL1631996, KBio2_000776, Spectrum_000296, SpecPlus_000732, Spectrum4_001170, Spectrum5_001775, AC1O8FN5, KBioGR_001779, KBioSS_000776, DivK1c_006828, KBio1_001772, KBio2_003344, KBio2_005912, BDBM50091083, EPIGALLOCATECHIN OCTAMETHYL ETHER, [(2R,3R)-5,7-dimethoxy-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trimethoxybenzoate, 3,4,5-Trimethoxybenzoic acid (2R)-2alpha-(3,4,5-trimethoxyphenyl)-5,7-dimethoxychroman-3alpha-yl ester


ID: 2142

chemical graph of compound 2142



InChIKey: SUQFMFHTLHMZNM-SLBLICBISA-N
SMILES: CC(=O)O[C@H]1C[C@H](C(C2[C@]1(C3CC[C@]4([C@@H](OC(=O)C=C4[C@@]3([C@@H](C2)OC(=O)C)C)C5=COC=C5)C)C)(C)C)OC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6708722
synonyms found at PubChem are:
KBio2_006264, DEOXYKHIVORIN, Spectrum_000648, SpecPlus_000625, AC1O8FLK, Spectrum2_000251, Spectrum3_000041, Spectrum4_001323, Spectrum5_000165, BSPBio_001761, KBioGR_001785, KBioSS_001128, SPECTRUM100139, DivK1c_006721, SPBio_000062, SCHEMBL14196996, KBio1_001665, KBio2_001128, KBio2_003696, KBio3_000921, CCG-39812, SDCCGMLS-0066330.P001, NCGC00179028-01, SR-05000002755, SR-05000002755-1, BRD-A39660642-001-02-3, BRD-A39660642-001-03-1, [(1R,4bR,5R,8R,10S,10aS,12aR)-8,10-diacetyloxy-1-(furan-3-yl)-4b,7,7,10a,12a-pentamethyl-3-oxo-1,5,6,6a,8,9,10,10b,11,12-decahydronaphtho[2,1-f]isochromen-5-yl] acetate


ID: 2143

chemical graph of compound 2143



InChIKey: SUWREQRNTXCCBL-UHFFFAOYSA-N
SMILES: C1CNCC=C1C(=O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 155107
synonyms found at PubChem are:
ISOGUVACINE HYDROCHLORIDE, 68547-97-7, 1,2,3,6-Tetrahydro-4-pyridinecarboxylic acid hydrochloride, 1,2,3,6-tetrahydropyridine-4-carboxylic acid hydrochloride, 4-Pyridinecarboxylic acid, 1,2,3,6-tetrahydro-, hydrochloride, Isoguvacine (hydrochloride), 1,2,3,6-Tetrahydro-pyridine-4-carboxylic acid hydrochloride, 1,2,5,6,-Tetrahydroisonicotinic acid Hydrochloride, 1,2,3,6-TETRAHYDRO-4-PYRIDINECARBOXYLIC ACID HCL, SR-01000075611, Isoguvacine HCl, AC1L4DMR, MLS000859962, SPECTRUM1502129, CHEMBL540303, SCHEMBL7958625, Isoguvacine hydrochloride, solid, 1,2,3,6-tetrahydro-4-pyridinecarboxylicacidhydrochloride, KS-00000AIF, DTXSID00218663, MolPort-003-983-601, SUWREQRNTXCCBL-UHFFFAOYSA-N, 64603-90-3 (Parent), Tox21_500561, BN0277, MFCD00055192, AKOS015847455, AKOS025243370, CCG-221865, CS-6967, LP00561, TRA0081918, NCGC00093946-01, NCGC00093946-02, NCGC00093946-03, NCGC00261246-01, AK154352, AS-31641, SC-49604, SC-49605, SMR000326821, SY012592, AX8223448, HY-100810, TR-022104, B6230, EU-0100561, FT-0670465, G-002, I0871, Z-2044, 1,2,5,6-tetrahydroisonicotinic acid hydrochloride, I02-4338, SR-01000075611-1, SR-01000075611-3, 1,2,3,6-Tetrahydro-pyridine-4-carboxylic acid hydr, 1,2,3,6-Tetrahydro-pyridine-4-carboxylic acidhydrochloride, SCHEMBL15260680


ID: 2144

chemical graph of compound 2144



InChIKey: SUYVUBYJARFZHO-UHFFFAOYSA-N
SMILES: C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O

biological descriptors:

CFTR relevance: CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"Z Zhou" "SG Bompadre" "M Li" "H Miki" "TC Hwang"


CID is 622
synonyms found at PubChem are:
2'-Deoxyadenosine 5'-triphosphate disodium salt(dATP), SCHEMBL889289, AC1L19N7, AC1Q6S41, SGCUT00221, CTK8H4367, to_000043, VZ21750, 9-[2-deoxy-5-o-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]-9h-purin-6-amine, L000216, [[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate


ID: 2145

chemical graph of compound 2145



InChIKey: SVJKYIUJRJEABK-UHFFFAOYSA-L
SMILES: C1=CC2=C3C(=CC(=C2C(=C1)S(=O)(=O)N)[N+](=O)[O-])N=C(C(=N3)[O-])[O-].[Na+].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3272523
synonyms found at PubChem are:
6-Nitro-7-sulfamoylbenzo[f]quinoxaline-2,3-dione, Disodium Salt, 479347-86-9, CTK8E6584, RT-010697, FT-0673006, NBQX disodium salt, NBQX disodium, 1,2,3,4-Tetrahydro-6-nitro-2,3-dioxo-benzo[f]quinoxaline-7-sulfonamide disodium salt, 2,3-DIOXO-6-NITRO-1,2,3,4-TETRAHYDROBENZO[F]QUINOXALINE-7-SULFONAMIDE DISODIUM SALT, disodium 6-nitro-7-sulfamoylbenzo[f]quinoxaline-2,3-diolate, FG9202 disodium, NBQX, Disodium Salt, NCGC00016174-01, Lopac-N-183, AC1O1JFX, AC1MN6K0, CHEMBL1257130, CTK8G1696, MolPort-003-849-601, HMS3262H06, HMS3267C04, Tox21_500912, BN0608, AKOS024418743, CCG-222216, LP00912, MB01142, NCGC00016174-02, NCGC00094223-01, NCGC00261597-01, B6566, EU-0100912, N-183, 2,3-DIHYDROXY-6-NITRO-7-SULPHAMOYLBENZO(F)-QUINOXALINE 2NA, 6-NITRO-7-SULPHAMOYLBENZO(F)-QUINOXALINE-2,3-DIONE 2NA, SODIUM 6-NITRO-7-SULFAMOYLBENZO[F]QUINOXALINE-2,3-BIS(OLATE), 11876-58-7


ID: 2146

chemical graph of compound 2146



InChIKey: SVURIXNDRWRAFU-OGMFBOKVSA-N
SMILES: C[C@@H]1CC[C@@H]2[C@]13CC[C@@]([C@H](C3)C2(C)C)(C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 65575
synonyms found at PubChem are:
Cedrol, (+)-Cedrol, 77-53-2, alpha-Cedrol, 8betaH-Cedran-8-ol, a-Cedrol, Cedrol (natural), Cedarwood oil alcohols, (8R)-cedran-8-ol, cedar camphor, UNII-63ZM9703BO, Cedrol (6CI,7CI), EINECS 201-035-6, NSC 403883, AI3-02178, CHEMBL1974890, CHEBI:10217, 63ZM9703BO, NSC403883, [3R-(3alpha,3abeta,6alpha,7beta,8aalpha)]-octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-ol, 1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, (3R,3aS,6R,7R,8aS)-, .alpha.-Cedrol, (1S,2R,5S,7R,8R)-2,6,6,8-Tetramethyltricyclo[5.3.1.01.5]undecan-8-ol, (3R-(3alpha,3Abeta,6alpha,7beta,8aalpha))-octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-ol, 8.beta.H-Cedran-8-ol, Cedrol Crystals, 1H-3a, octahydro-3,6,8,8-tetramethyl-, [3R-(3.alpha.,3a.beta.,6.alpha.,7.beta.,8a.alpha.)]-, Cedrol, redistilled, (+)-Cedryl alcohol, 8-betaH-Cedran-8-ol, AC1Q29DU, DSSTox_CID_21269, DSSTox_RID_79672, DSSTox_GSID_41269, SCHEMBL107488, (7beta,8alpha)-cedran-8-ol, 8betaH-Cedran-8-ol (8CI), AC1L23J2, 8-betaH-Cedran-8-ol (8CI), DTXSID1041269, CTK8F1448, HSDB 8265, (+)-Cedrol, analytical standard, MolPort-003-910-655, SVURIXNDRWRAFU-OGMFBOKVSA-N, NSC46153, ZINC3978626, Tox21_202945, BDBM50430739, MFCD00062952, NSC-46153, AKOS024319138, LMPR0103690007, NSC-403883, CAS-77-53-2, NCGC00260491-01, AN-23913, AS-13700, CC-00086, LS-90492, NCI60_003818, ST2414060, FT-0623526, C09631, J10131, Y-9227, 062C952, C-12442, (+)-Cedrol, >=99.0% (sum of enantiomers, GC), [3R-(3alpha,3abeta,6alpha,7beta,8aalpha)]-Octa-hydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-ol, 13567-37-8


ID: 2147

chemical graph of compound 2147



InChIKey: SVUVYHFYZBCYRF-UHFFFAOYSA-N
SMILES: CC(=O)C1=C(C=C2C(=C1)C=CC(O2)(C)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 100768
synonyms found at PubChem are:
Eupatoriochromene, 19013-03-7, DEMETHYLENCECALIN, Desmethylencecalin, 7-demethylencecalin, 1-(7-hydroxy-2,2-dimethyl-2H-chromen-6-yl)ethanone, Ethanone, 1-(7-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-, UNII-O9Y1UY34HC, O9Y1UY34HC, CHEBI:4936, NSC 363789, Spectrum_000670, SpecPlus_000198, AC1L2PFX, Spectrum2_000671, Spectrum3_001246, Spectrum4_001452, Spectrum5_000063, C09006, AC1Q5G9Q, BSPBio_002752, KBioGR_001963, KBioSS_001150, SPECTRUM300061, CHROMENE DERIV (HERZ), DivK1c_006294, SPBio_000761, CHEMBL443462, MEGxp0_001834, KBio1_001238, KBio2_001150, KBio2_003718, KBio2_006286, KBio3_002252, DTXSID70172485, MolPort-001-742-563, SVUVYHFYZBCYRF-UHFFFAOYSA-N, HMS1923G11, ZINC897926, CCG-38569, NSC363789, AKOS022652862, CS-W000239, MCULE-8240932553, NSC-363789, SDCCGMLS-0066474.P001, NCGC00095249-01, NCGC00095249-02, NCGC00095249-03, NCGC00095249-04, 4CN-1407, W1947, W1963, 1-(7-hydroxy-2,2-dimethylchromen-6-yl)ethanone, 1-(7-hydroxy-2,2-dimethyl-chromen-6-yl)ethanone, 6-Acetyl-7-hydroxy-2,2-dimethyl-2H-1-benzopyran, BRD-K55704455-001-02-2, 1-(7-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-ethanone, 1-(7-Hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-ethanone, Ethanone,1-(7-hydroxy-2,2-dimethyl-2H-1- benzopyran-6-yl)-, InChI=1/C13H14O3/c1-8(14)10-6-9-4-5-13(2,3)16-12(9)7-11(10)15/h4-7,15H,1-3H


ID: 2148

chemical graph of compound 2148



InChIKey: SWELIMKTDYHAOY-UHFFFAOYSA-N
SMILES: C1=C(NC(=NC1=O)N)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 2944
synonyms found at PubChem are:
2,4-Diamino-6-hydroxypyrimidine, 56-06-4, 2,6-diaminopyrimidin-4-ol, 2,6-Diaminopyrimidin-4(1H)-one, 2,6-Diamino-4-hydroxypyrimidine, 100643-27-4, 2,6-Diamino-4-pyrimidinol, 4(1H)-Pyrimidinone, 2,6-diamino-, 2,6-Diamino-4-pyrimidinone, 2,6-diaminopyrimidin-4(3H)-one, 2,6-Diamino-1H-pyrimidin-4-one, 2,4-Diaminohypoxanthine, 2,6-Diamino-4(1H)-pyrimidinone, 2,6-diamino-3,4-dihydropyrimidin-4-one, 2,6-Diaminopyrimidin-4-one, 4(3H)-pyrimidinone, 2,6-diamino-, 2,4-DAHP, UNII-EDH7CNS75I, 2,6-Diamino-3H-pyrimidin-4-one, 2,6-Diamino-4(3H)-pyrimidinone, NSC 9302, 6-Aminoisocytosine, NSC 44914, 2,4-Diamino-6-pyrimidinone, NSC 680818, 143504-99-8, EINECS 200-254-4, EDH7CNS75I, 2,4-Diaminopyrimidin-6-ol, AI3-52085, NSC9302, 2,4-Diamino-6-hydroxypyrimidiine, SWELIMKTDYHAOY-UHFFFAOYSA-N, NSC680818, NCGC00024607-01, 2,6-diamino-1,4-dihydropyrimidin-4-one, DSSTox_CID_28964, DSSTox_RID_83229, DSSTox_GSID_49038, 4(1H)-Pyrimidinone,6-diamino-, CAS-56-06-4, 2-Aminoisocytosine, SMR001230698, SR-01000076242, DHAP-2,4, PubChem7054, Tocris-0476, AC1L1ETQ, Lopac-D1920-6, AC1Q51QT, 2,4-Diamino-6-pyrimidinol, Lopac0_000419, SCHEMBL94169, 2,6-diamino-4-oxopyrimidine, 2,6-diamino-pyrimidin-4-ol, KSC495S0J, MLS002153230, MLS004491797, ACMC-20976c, 2,6-diamino-4-oxo-pyrimidine, 4-Pyrimidinol, 2,6-diamino-, AC1Q51K9, CHEMBL1255934, DTXSID4049038, SCHEMBL12284066, 2,6-diaminohydropyrimidin-4-one, CTK3J5904, CTK7D5149, CTK7E0733, KS-00000JRQ, 6-Hydroxy-2,4-pyrimidinediamine, 58470-85-2 (sulfate), MolPort-000-875-437, MolPort-001-765-139, 2,4-diamino-6-hydroxy-pyrimidine, HMS2234I21, HMS3261C20, HMS3370M17, AC1Q6931, ALBB-027441, BCP07305, NSC-9302, NSC44914, ZINC8602956, 4-Pyrimidinol,2,6-diamino-(9CI), Tox21_113576, Tox21_500419, ANW-13570, BBL003829, BBL007935, MFCD00006098, NSC-44914, SBB004252, STK387479, STK508805, 2,4-?Diamino-?6-?hydroxypyrimidine, AKOS000120881, AKOS002676346, AKOS016000171, Tox21_113576_1, 2,6-bis(azanyl)-1H-pyrimidin-4-one, 4-Pyrimidinol, 2,6-diamino- (9CI), CCG-204511, EBD1821296, LP00419, MCULE-5011664599, NSC-680818, PS-4212, PS-4458, RTR-037093, TRA0051858, DAHP; 2,4-Diamino-6-hydroxypyrimidine, KS-00002A75, 2,4-Diamino-6-hydroxypyrimidine, 96%, NCGC00015387-01, NCGC00015387-02, NCGC00015387-03, NCGC00015387-04, NCGC00015387-05, NCGC00015387-06, NCGC00024607-02, NCGC00024607-03, NCGC00247666-01, NCGC00261104-01, 2,4-DIAMINO-6(1H)-PYRIMIDINONE, AC-23587, AJ-57700, AJ-57701, AN-24432, BC224587, BP-13216, BR-26131, CJ-13271, HC210088, KB-62342, SC-46582, SC-48881, SC-48904, ST069382, AB0010985, AB0219348, LS-175686, TR-037093, 4(3H)-Pyrimidinone, 2,6-diamino- (9CI), AM20100370, B6314, EU-0100419, FT-0609969, R1730, ST24038789, T7987, KS-00000960, M-7393, 043D013, 4(1H)-Pyrimidinone, 2,6-diamino- (8CI,9CI), A830906, AB-323/25048074, D1920-6, I03-0242, Q-200181, SR-01000076242-1, SR-01000076242-3, I14-13895, F1918-0034, InChI=1/C4H6N4O/c5-2-1-3(9)8-4(6)7-2/h1H,(H5,5,6,7,8,9, 40306-60-3, 41982-31-4, 863767-89-9


ID: 2149

chemical graph of compound 2149



InChIKey: SWIJYDAEGSIQPZ-UHFFFAOYSA-N
SMILES: CCN(CC)CC#CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 91505
synonyms found at PubChem are:
Oxybutynin chloride, Oxybutynin hydrochloride, 1508-65-2, Oxybutynin HCl, Dridase, Tropax, Ditropan Xl, Oxybutynin (chloride), Oxibutinina hydrochloride, EINECS 216-139-7, alpha-Phenylcyclohexaneglycolic acid 4-(diethylamino)-2-butynyl ester hydrochloride, MJ 4309-1, MLS000069688, 4-(Diethylamino)but-2-ynyl cyclohexylphenylglycolate hydrochloride, SMR000058490, (R)-Oxybutynin Chloride, 4-Diethylamino-2-butynyl phenyl(cyclohexyl)glycolate hydrochloride, 4-(Diethylamino)-2-butynyl alpha-phenylcyclohexaneglycolate hydrochloride, C22H32ClNO3, Gelnique, 4-(Diethylamino)-2-butynyl (+-)-alpha-phenylcyclohexaneglycolate hydrochloride, CHEBI:7857, 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride, Cyclohexaneglycolic acid, alpha-phenyl-, 4-(diethylamino)-2-butynyl ester, hydrochloride, Benzeneacetic acid, alpha-cyclohexyl-alpha-hydroxy-, 4-(diethylamino)-2-butynyl ester hydrochloride, Benzeneacetic acid, alpha-cyclohexyl-alpha-hydroxy-, 4-(diethylamino)-2-butynyl ester hydrochloride, (+-)-, SR-01000000184, Oxybutynin chloride [USAN], Oxybutynin chloride [USAN:USP], 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate;hydrochloride, Ditropan (TN), Gelnique (TN), Prestwick_621, Opera_ID_1330, NCGC00016583-01, D05KZK, D0R1DH, Oxybutynin chloride (USP), CAS-1508-65-2, AC1L3M7P, CHEMBL1133, DSSTox_CID_25356, DSSTox_RID_80822, C22H31NO3.HCl, DSSTox_GSID_45356, SCHEMBL25751, MLS001148211, MLS002222232, REGID_for_CID_91505, Oxybutynin hydrochloride (JAN), SMT-D002, Jsp002882, DTXSID3045356, CTK8G2229, HY-B0267A, KS-00000ZDA, 5633-20-5 (Parent), HOB-294, (S)-4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride, MolPort-003-666-668, SWIJYDAEGSIQPZ-UHFFFAOYSA-N, HMS1568J16, Pharmakon1600-01505399, (R,S) - Oxybutynin Hydrochloride, BCP12138, Tox21_110507, Tox21_500923, BG0595, MFCD00072150, NSC759108, s3117, AKOS015895349, API0003718, CCG-213420, CS-2256, H33O205, KS-1377, LP00923, MCULE-5193326065, NC00580, NSC-759108, VA11467, NCGC00094234-01, NCGC00094234-02, NCGC00261608-01, AN-49346, CPD000058490, DL-06003, H815, LS-56862, SAM002564226, SC-18892, MJ-4309-1, EU-0100923, FT-0082889, FT-0603563, Oxybutynin chloride, >=98% (TLC), powder, ST24048864, ST51015085, D00722, J10411, O 2881, A809082, C-21602, I06-0708, J-008750, SR-01000000184-2, SR-01000000184-7, Oxybutynin chloride, meets EP, USP testing specifications, Oxybutynin hydrochloride (transdermal patch, overactive bladder), 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate, chloride, Oxybutynin chloride, United States Pharmacopeia (USP) Reference Standard, Oxybutynin hydrochloride (transdermal patch, overactive bladder), Hisamitsu, Oxybutynin hydrochloride, European Pharmacopoeia (EP) Reference Standard, (R)-|A-Phenylcyclohexaneglycolic Acid 4-(Diethylamino)-2-butynyl Ester, Hydrochloride, (S)-|A-Phenylcyclohexaneglycolic Acid 4-(Diethylamino)-2-butynyl Ester, Hydrochloride, 2-cyclohexyl-2-hydroxy-2-phenylacetic acid 4-(diethylamino)but-2-ynyl ester hydrochloride, 4-(diethylamino)but-2-yn-1-yl 2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride, 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenyl-acetate hydrochloride, 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate hydrochloride, AC1LCW7R, AKOS026750014, 4-(diethylamino)but-2-yn-1-yl cyclohexyl(hydroxy)phenylacetate hydrochloride, 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate; hydron; chloride


ID: 2150

chemical graph of compound 2150



InChIKey: SWJLTKXURNHVHE-UPWXJBBJSA-N
SMILES: CC[C@H](C)/C=C(\C)/C=C/C1=CC2=C(C(=O)[C@](C(=O)C2=CO1)(C)OC(=O)C)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6436015
synonyms found at PubChem are:
Sclerotiorin, UNII-BA54VZ8Z50, BA54VZ8Z50, 549-23-5, AC1O5KXO, MLS000563069, CHEMBL1095515, SCHEMBL17241989, MolPort-008-268-243, SWJLTKXURNHVHE-UPWXJBBJSA-N, HMS2267F03, ZINC5247757, AKOS030213219, (R-(R*,S*-(E,E)))-7-(Acetyloxy)-5-chloro-3-(3,5-dimethyl-1,3-heptadienyl)-7-methyl-6H-2-benzopyrane-6,8(7H)-dione, SMR001215839, [(7R)-5-chloro-3-[(1E,3E,5S)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxo-isochromen-7-yl] acetate, [(7R)-5-chloro-3-[(1E,3E,5S)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxoisochromen-7-yl] acetate, 6H-2-Benzopyran-6,8(7H)-dione, 7-(acetyloxy)-5-chloro-3-[(1E,3E,5S)-3,5-dimethyl-1,3-heptadienyl]-7-methyl-, (7R), 6H-2-Benzopyrane-6,8(7H)-dione, 7-(acetyloxy)-5-chloro-3-(3,5-dimethyl-1,3-heptadienyl)-7-methyl-, (R-(R*,S*-(E,E)))-, 7-(Acetyloxy)-5-chloro-3-[(1E,3E,5S)-3,5-dimethyl-1,3-heptadien-1-yl]-7-methyl-6H-2-benzopyran-6,8(7H)-dione


ID: 2151

chemical graph of compound 2151



InChIKey: SWKDMSRRIBZZAY-UHFFFAOYSA-N
SMILES: C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 17275
synonyms found at PubChem are:
Antazoline hydrochloride, 2508-72-7, Antazoline HCl, Fenazolina, Histazine, Antazoline (hydrochloride), 2-(N-Benzylanilinomethyl)-2-imidazoline hydrochloride, Antazolinium chloratum, Antistine hydrochloride, Phenazoline hydrochloride, UNII-FP8Q8F72JH, EINECS 219-719-8, FP8Q8F72JH, MLS000028599, 2-Phenylbenzylaminomethylimidazoline hydrochloride, 2-(N-Phenyl-N-benzylaminomethyl)imidazoline hydrochloride, SMR000058731, 2-Imidazoline, 2-((N-benzylanilino)methyl)-, monohydrochloride, DSSTox_CID_27762, DSSTox_RID_82539, DSSTox_GSID_47782, 2-(N-Benzylanilino)methyl-2-imidazoline, hydrochloride, 2-IMIDAZOLINE, 2-((N-BENZYLANILINO)METHYL)-, HYDROCHLORIDE, 91-75-8 (Parent), N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline hydrochloride, N-Benzyl-N-((4,5-dihydro-1H-imidazol-2-yl)methyl)aniline hydrochloride, 4,5-Dihydro-N-phenyl-N-(phenylmethyl)-1H-imidazole-2-methanamine hydrochloride, SR-01000000255, NCGC00016613-01, (2-imidazolin-2-ylmethyl)phenylbenzylamine, chloride, CAS-2508-72-7, Antazoline hydrochloride [USP], N-benzyl-N-[(4,5-dihydro-1H-imidazol-2-yl)methyl]aniline hydrochloride, Prestwick_82, Phenazolinum (TN), Antazolinehydrochloride, N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline,hydrochloride, N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline;hydrochloride, Opera_ID_1387, AC1L29OE, Antazoline Hydrochloride,(S), labotest-bb lt00134672, MLS001148371, MLS002153486, MLS002222161, REGID_for_CID_17275, CHEMBL1256819, DTXSID1047782, CTK8B2946, KS-00000VVI, MolPort-003-940-371, HMS1568D18, HY-B1067, Tox21_110524, ANW-41427, MFCD00058145, SBB057007, AKOS015916586, Tox21_110524_1, AC-8174, AN-8292, CCG-220258, CS-4623, MCULE-4468873456, VA10298, NCGC00016613-10, NCGC00180986-01, LS-79573, KB-280871, TR-011484, A2132, ST50993904, D07459, 2-(n-phenyl-n-benzyl-aminomethyl)-imidazoline hcl, SR-01000000255-3, SR-01000000255-6, I14-51834, 2-(N-BENZYLANILINOMETHYL) IMIDAZOLINE HYDROCHLORIDE, Antazoline Hydrochloride 1.0 mg/ml in Methanol (as free base), benzyl-(4,5-dihydro-1h-imidazol-2-ylmethyl)-phenyl-amine hcl, Antazoline hydrochloride, European Pharmacopoeia (EP) Reference Standard, AC1LCWAX, SCHEMBL1649651, AKOS026749787, N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline; hydron; chloride


ID: 2152

chemical graph of compound 2152



InChIKey: SWOUGRBFXFILIB-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.C(CS(=O)(=O)O)S(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 91499
synonyms found at PubChem are:
Prochlorperazine edisylate, 1257-78-9, Compazine syrup, Compazine Injection, UNII-PG20W5VQZS, Prochlorperazine Edisylate, USP, prochlorperazine ethanedisulfonate, Prochlorperazine ethane disulfonate, EINECS 215-019-1, PG20W5VQZS, Prochlorperazine edisylate [USP], 2-Chloro-10-(3-(1-methyl-4-piperazinyl)propyl)phenothiazine edisylate, 2-Chloro-10-(3-(4-methyl-1-piperazinyl)propyl)phenothiazine 1,2-ethanedisulfonate (1:1), Prochlorperazine edisylate (USP), MLS001148133, Phenothiazine, 2-chloro-10-(3-(1-methyl-4-piperazinyl)propyl)-, ethanedisulfonate, 10H-Phenothiazine, 2-chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-, 1,2-ethanedisulfonate (1:1), Ethane-1,2-disulphonic acid, compound with 2-chloro-10-(3-(4-methylpiperazin-1-yl)propyl)-10H-phenothiazine (1:1), SMR000653454, 2-Chloro-10-[3-(4-methyl-1-piperazinyl)propyl]phenothiazine 1,2-ethanedisulfonate (1:1), Prochlorperazine edisylate [USAN], Compazine syrup (TN), AC1Q6XA2, SCHEMBL40855, C22H30ClN3O6S3, SPECTRUM1500505, AC1L3M77, CHEMBL1201154, DTXSID4074483, HMS501E15, MolPort-003-666-268, HMS1920L08, HMS2092C09, HMS2234E05, HMS3372M12, Pharmakon1600-01500505, BCP15822, C20H25N3S.C2H6O6S2, CCG-39235, NSC665801, NSC757299, AKOS030228220, API0025987, NSC-665801, NSC-757299, KS-000000G8, NCGC00094768-01, NCGC00094768-02, NCGC00094768-03, 1,2-Ethanedisulfonic acid, compd. with 2-chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-10H-phenothiazine (1:1), 7081-50-7, LS-105400, W0065, D02609, SR-05000001704, SR-05000001704-1, 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine; ethane-1,2-disulfonic acid


ID: 2153

chemical graph of compound 2153



InChIKey: SWOVVKGLGOOUKI-ZHGGVEMFSA-N
SMILES: CC(C)[C@@]12[C@@H](O1)[C@H]3[C@@]4(O3)[C@]5(CCC6=C([C@@H]5C[C@H]7[C@]4(C2=O)O7)COC6=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 65411
synonyms found at PubChem are:
Triptonide, 38647-11-9, (-)-triptonide, Spectrum_001724, SpecPlus_000568, Spectrum2_000477, Spectrum5_001806, KBioSS_002204, DivK1c_006664, Triptolide,14-deoxy-14-oxo, SPBio_000614, AC1L237D, CHEMBL205190, SCHEMBL4884926, Triptonide, >=98% (HPLC), KBio1_001608, KBio2_002204, KBio2_004772, KBio2_007340, Triptolide, 14-deoxy-14-oxo-, CHEBI:132267, MolPort-016-638-464, BCP26007, ZINC8214966, CCG-38708, NSC165677, AKOS015896754, CS-0318, NSC 165677, NSC-165677, NSC 165677;PG 492, HY-32736, NCI60_001273, SC-14013, AB0035809, N2407, ST24050308, Y0208, W-5087, 647T119, I07-0219, Q-100449, (3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-6a-isopropyl-8b-methyl-3b,4,4a,7a,7b,8b,9,10-octahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione


ID: 2154

chemical graph of compound 2154



InChIKey: SWUARLUWKZWEBQ-VQHVLOKHSA-N
SMILES: C1=CC=C(C=C1)CCOC(=O)/C=C/C2=CC(=C(C=C2)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5281787
synonyms found at PubChem are:
Caffeic acid phenethyl ester, Phenethyl caffeate, 104594-70-9, CAPE, Capeee, Phenylethyl caffeate, phenethyl 3-(3,4-dihydroxyphenyl)acrylate, 115610-29-2, UNII-G960R9S5SK, caffeic acid phenylethyl ester, 2-phenylethyl caffeate, Caffeic acid-phenethyl ester, CHEBI:8062, CHEMBL319244, G960R9S5SK, 100981-80-4, Caffeic acid 2-phenylethyl ester, PHENETHYL CAFFEATE (CAPE), SWUARLUWKZWEBQ-VQHVLOKHSA-N, 2-phenylethyl 3-(3,4-dihydroxyphenyl)-2-propenoate, Caffeic Acid Phenethyl Ester, Synthetic, 2-phenylethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate, (E)-phenethyl 3-(3,4-dihydroxyphenyl)acrylate, 2-phenylethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate, 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)acrylate, phenethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate, 2-Phenylethyl (2e)-3-(3,4-Dihydroxyphenyl)prop-2-Enoate, 3-(3,4-Dihydroxyphenyl)-2-propenoic acid 2-phenylethyl ester, SMR000326751, 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2-phenylethyl ester, SR-01000075785, phenethyl 3,4-dihydroxycinnamate, QAP, caffeic acidphenethylester, caffeic acid phenethylester, D06YGF, AC1NQZ32, caffeic acid phenylethylester, Lopac0_000269, BSPBio_001560, BSPBio_003586, MLS000859889, MLS002207297, SPECTRUM1502209, ZINC1083, Jsp000448, DTXSID8040987, CHEBI:93478, MolPort-003-665-504, FR102, HMS1361N22, HMS1791N22, HMS1989N22, HMS2233J04, HMS3260F20, HMS3402N22, HMS3649C16, Caffeic acid beta-phenylethyl ester, Trans-Caffeic Acid Phenethyl Ester, BCP27877, Caffeic acid phenethyl ester(CAPE), EBD26363, HY-N0274, Tox21_500269, BDBM50029207, Caffeic acid phenethyl ester (CAPE), CCG-39542, MFCD00866470, s7414, 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2-phenylethyl ester, (E)-, AKOS015888207, AC-8896, LP00269, RP17623, RTR-001007, IDI1_034030, QTL1_000016, NCGC00093727-01, NCGC00093727-02, NCGC00093727-03, NCGC00093727-04, NCGC00093727-05, NCGC00093727-06, NCGC00093727-07, NCGC00093727-08, NCGC00093727-09, NCGC00260954-01, AJ-07958, AN-33053, AS-14021, I793, SC-19142, ZB000242, LS-123626, TR-001007, CS-0008774, EU-0100269, ST24031525, B-6327, C 8221, C10484, I01-0894, SR-01000075785-1, SR-01000075785-6, SR-01000075785-9, BRD-K84709232-001-02-6, BRD-K96188950-001-02-9, BRD-K96188950-001-04-5, Caffeic acid phenethyl ester, >=97% (HPLC), powder, I14-33952, 3-(3,4-Dihydroxy-phenyl)-acrylic acid phenethyl ester, (E)-3-(3,4-Dihydroxy-phenyl)-acrylic acid phenethyl ester


ID: 2155

chemical graph of compound 2155



InChIKey: SWXXKWPYNMZFTE-UHFFFAOYSA-N
SMILES: CCSC(=N)N.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 200213
synonyms found at PubChem are:
S-Ethylisothiourea hydrobromide, 1071-37-0, 2-Ethyl-2-thiopseudourea hydrobromide, Ethiron, Ethiron bromide, ethyl carbamimidothioate hydrobromide, EIT hydrobromide, S-Ethylthiuronium bromide, S-Ethylisothiouronium hydrobromide, Bromide S-ethylisothiuronium, S-Ethylisothiuronium bromide, USAF EL-18, Isothuron hydrobromide, 2-Ethylisothiourea hydrobomide, Isothurone hydrobromide, WR 539, 2-Ethylisothiourea hydrobromide, (ethylsulfanyl)methanimidamide hydrobromide, Pseudourea, 2-ethyl-2-thio-, hydrobromide, 2-ethylisothiourea, S-Ethyl-ITU, HBr, S-Ethylisothiourea, HBr, NSC 27208, 2-Ethyl-2-thiopseudourea, hydrobromide, Carbamimidothioic acid, ethyl ester, monohydrobromide, S-Ethylisothio Urea, Hydrobromide, C3H8N2S.HBr, EN300-70503, 133514-72-4, SR-01000075856, S-Ethylisothiourea HBr, WLN: SHYZUN2, S-Ethylthioureahydrobromide, ACMC-2098nn, D0V4NQ, Pseudourea, 2-ethyl-2-thio-, monohydrobromide, S-ethylthiourea hydrobromide, AC1L43VD, AC1Q23FK, SCHEMBL18169, Ethyl isothiourea hydrobromide, S-EthylisothioureaHydrobromide, MLS002153234, SPECTRUM1505161, S-ethylisothiourea-hydrobromide, CHEMBL1255945, CTK4A5022, (S)-Ethylisothiourea hydrobromide, 2986-20-1 (Parent), DTXSID90147913, MolPort-002-322-427, SWXXKWPYNMZFTE-UHFFFAOYSA-N, BCP20133, NSC27208, Tox21_500491, 2034AH, 7080AF, ANW-15489, MFCD00012585, NSC-27208, AKOS016353460, CCG-221795, LP00491, MCULE-2161729152, NE10708, KS-000017M3, NCGC00093894-01, NCGC00093894-02, NCGC00261176-01, SC-20585, SC-53442, SMR001230700, 2-Ethyl-2-thio-pseudourea Monohydrobromide, KB-112797, LS-126148, TC-104234, 2-Ethyl-2-thiopseudourea hydrobromide, 98%, B6481, E0182, EU-0100491, FT-0633285, E 3149, Carbamimidothioic Acid Ethyl Ester, Hydrobromide, C-49559, J-001710, SR-01000075856-1, SR-01000075856-3, SR-01000075856-7, Pseudourea, 2-ethyl-2-thio-, monohydrobromide (8CI), Carbamimidothioic acid, ethyl ester, monohydrobromide (9CI), S-ethylthiouronium bromide, SCHEMBL2916648, AKOS023093342


ID: 2156

chemical graph of compound 2156



InChIKey: SXJIZQPZESTWLD-UHFFFAOYSA-N
SMILES: CC(C)SC1=CC2=C(C=C1)N=C(N2)NC(=O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6604471
synonyms found at PubChem are:
Methiazole, 74239-55-7, Prestwick-14D11, Prestwick0_001080, Prestwick1_001080, Prestwick2_001080, Prestwick3_001080, AC1O7GJ1, Methiazole, 98% (TLC), BSPBio_001100, MLS002154145, SPBio_003000, BPBio1_001210, SCHEMBL9882802, CHEMBL1354363, CHEBI:94268, CTK8G0826, DTXSID50424979, MolPort-044-562-735, HMS1571G22, HMS2098G22, HMS2231A21, HMS3370O02, HMS3715G22, ZINC4245701, CCG-221080, NCGC00017007-01, NCGC00017007-02, SMR001233449, AB00514034, Methyl 5-(isopropylthio)benzimidazole-2-carbamate, SR-01000841828, SR-01000841828-2, BRD-K02764365-001-03-7, BRD-K02764365-001-05-2, F2173-0224, methyl (5-(isopropylthio)-1H-benzo[d]imidazol-2-yl)carbamate, methyl N-(6-propan-2-ylsulfanyl-1H-benzimidazol-2-yl)carbamate


ID: 2157

chemical graph of compound 2157



InChIKey: SXTAYKAGBXMACB-DPVSGNNYSA-N
SMILES: CS(=N)(=O)CC[C@@H](C(=O)O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 89034
synonyms found at PubChem are:
L-Methionine sulfoximine, 15985-39-4, (2S)-2-amino-4-(S-methylsulfonimidoyl)butanoic acid, L-Methionine [R,S]-Sulfoximine, Methionine sulfoximine (L), Butanoic acid, 2-amino-4-(S-methylsulfonimidoyl)-, (2S)-, CHEBI:28490, L-S-(3-Amino-3-carboxypropyl)-S-methylsulfoximine, MFCD00002621, L-Methionine (R,S)-sulfoximine, (2S)-2-AMINO-4-(METHYLSULFONIMIDOYL)BUTANOIC ACID, L-Methionine-S,R-sulfoximine, Prestwick_805, L-Methionine-Sulfoximine, AC1Q6THF, Prestwick0_000523, Prestwick1_000523, Prestwick2_000523, Prestwick3_000523, Lopac0_000797, BSPBio_000505, SCHEMBL187872, (2S)-2-Amino-4-(S-methylsufonimidoyl)butanoic acid, SPBio_002426, AC1L3H04, BPBio1_000557, CHEMBL143324, CHEMBL1627202, Butanoic acid, 2-amino-4-(S-methylsufonimidoyl)-, (2S)-, MolPort-003-938-161, HMS1569J07, HMS2096J07, HMS3262O16, BCP10104, Tox21_500797, ANW-58082, AKOS015892783, CCG-204881, FCH3468694, LP00797, NCGC00094132-01, NCGC00094132-02, NCGC00094132-03, NCGC00094132-04, NCGC00261482-01, AS-40141, KB-53326, AX8136583, TC-146827, AB00513853, EU-0100797, FT-0084494, FT-0084789, AZ0001-0559, C03510, M 5379, Z-5302, (2S)-2-amino-4-(methylsulfonimidoyl)butyric acid, SR-01000075995, (2S)-2-azanyl-4-(methylsulfonimidoyl)butanoic acid, I04-1120, J-009648, SR-01000075995-1, (2S)-2-Amino-4-(S-methylsufonimidoyl)-butanoic acid, L-Methionine sulfoximine, certified reference material, TraceCERT(R), L-Methionine sulfoximine, PharmaGrade, Manufactured under appropriate GMP controls for pharma or biopharmaceutical production., L-methionine-D,L-sulphoximine, methionine sulfoximine zwitterion, CHEBI:87826, L-methionine sulfoximine zwitterion, (2S)-2-azaniumyl-4-(S-methanesulfonimidoyl)butanoate


ID: 2158

chemical graph of compound 2158



InChIKey: SXYZQZLHAIHKKY-GSTUPEFVSA-N
SMILES: C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@H]1C(=O)COC(=O)C(C)(C)C)C)O)Cl)C)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5282493
synonyms found at PubChem are:
CLOCORTOLONE PIVALATE, 34097-16-0, Clocortolone 21-pivalate, Cloderm, UNII-QBL8IZH14X, QBL8IZH14X, Purantix, MLS002154165, CHEBI:59583, 9-Chloro-6alpha-fluoro-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-pivalate, C27H36ClFO5, Cilder, CL 68, EINECS 251-826-5, SH 863, [2-[(6S,8S,9R,10S,11S,13S,14S,16R,17S)-9-chloro-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2,2-dimethylpropanoate, 9-chloro-6alpha-fluoro-11beta-hydroxy-16alpha-methyl-3,20-dioxopregna-1,4-dien-21-yl 2,2-dimethylpropanoate, Clocortolone pivalate [USAN:USP], NCGC00016824-01, Cloderm (TN), CAS-34097-16-0, Prestwick0_001119, Prestwick1_001119, Prestwick2_001119, Prestwick3_001119, AC1NR05P, clocortolone trimethylacetate, SCHEMBL5120, DSSTox_CID_25460, DSSTox_RID_80891, Clocortolone pivalate (USP), DSSTox_GSID_45460, BSPBio_001258, SPBio_003119, BPBio1_001383, CHEMBL1200975, DTXSID0045460, HMS1571O20, HMS2098O20, HMS2236M06, HMS3715O20, 9alpha-Chloro-6alpha-fluoro-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-pivalate, Pregna-1,4-diene-3,20-dione, 9-chloro-21-(2,2-dimethyl-1-oxopropoxy)-6-fluoro-11-hydroxy-16-methyl-, (6alpha,11beta,16alpha)-, ZINC4212603, Tox21_110632, CCG-221119, NCGC00179239-01, CLOCORTOLONE PIVALATE (200 MG), SMR001233464, AB00514058, Z6141, D02287, SR-01000838872, SR-01000838872-2, BRD-K38003476-001-03-4, 51434-44-7


ID: 2159

chemical graph of compound 2159



InChIKey: SYCBXBCPLUFJID-UHFFFAOYSA-N
SMILES: CCCCOC1=CC=C(C=C1)OCCCN2CCOCC2.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 73957
synonyms found at PubChem are:
Pramoxine hydrochloride, 637-58-1, Pramoxine HCl, Pramocaine hydrochloride, Prax Lotion, Tronolane, Tronothane hydrochloride, Pramocaine (hydrochloride), ProctoFoam-NS, UNII-88AYB867L5, HSDB 7220, EINECS 211-293-1, NSC 25573, Pramoxine hydrochloride [USP], MLS000028604, Morpholine, 4-[3-(4-butoxyphenoxy)propyl]-, hydrochloride, 88AYB867L5, 4-(3-(p-Butoxyphenoxy)propyl)morpholine hydrochloride, p-Butoxyphenyl gamma-morpholinopropyl ether hydrochloride, gamma-Morpholinopropyl 4-n-butoxyphenyl ether hydrochloride, Morpholine, 4-(3-(4-butoxyphenoxy)propyl)-, hydrochloride, SMR000058670, DSSTox_CID_27757, DSSTox_RID_82534, DSSTox_GSID_47777, Pramoxine hydrochloride (USP), Q-100732, 4-[3-(4-butoxyphenoxy)propyl]morpholine hydrochloride, p-Butoxyphenyl gamma-mopholinopropyl ether hydrochloride, Morpholine, 4-(3-(p-butoxyphenoxy)propyl)-, hydrochloride, NCGC00016529-01, CAS-637-58-1, 4-(3-(4-butoxyphenoxy)propyl)morpholine hydrochloride, 4-[3-(4-butoxyphenoxy)propyl]morpholine;hydrochloride, 4-[3-(p-Butoxyphenoxy)propyl]morpholine hydrochloride, SR-01000000243, Pramoxine, HCl, Tronothane (TN), Prestwick_1044, AC1L2KVS, Opera_ID_1593, AC1Q3DO8, MLS002222295, PRAXOMINE HYDROCHLORIDE, SCHEMBL180542, SPECTRUM1501139, CHEBI:8358, 140-65-8 (Parent), CHEMBL1201171, DTXSID2047777, KS-00000KOH, MolPort-003-666-364, HMS1570O13, HMS1921J07, Pharmakon1600-01501139, HY-B1319, NSC25573, Tox21_110477, KM0782, NSC-25573, NSC757847, s4092, AKOS015895041, Tox21_110477_1, AC-2094, API0003909, CCG-212937, CS-4643, MCULE-1100217744, NSC-757847, WLN: T6N DOTJ A3OR DO4 &GH, NCGC00016529-07, NCGC00094907-01, NCGC00094907-02, NCGC00094907-03, AN-14282, AS-12691, BC209186, LS-92487, AB0012331, FT-0603501, ST51015106, VU0239834-5, D00739, C-19995, I06-0440, Pramoxine hydrochloride, analytical standard, >=98%, SR-01000000243-3, 4-(3-(p-Butoxyphenoxy) propyl)-morpholine hydrochloride, 4-butoxy-1-(3-morpholin-4-ylpropoxy)benzene, chloride, 4-(3-(p-Butoxyphenoxy) propyl) -morpholine hydrochloride, p-Butoxyphenyl .gamma.-morpholinopropyl ether hydrochloride, .gamma.-Morpholinopropyl 4-N-butoxyphenyl ether hydrochloride, 4-[3-(4-Butoxyphenoxy)propyl]morpholine hydrochloride (1:1), Morpholine, 4-[3-(p-n-butoxyphenoxy )propyl]-, hydrochloride, Morpholine, 4-[3-(4-butoxyphenoxy)propyl]-, hydrochloride (1:1), Pramoxine hydrochloride, United States Pharmacopeia (USP) Reference Standard, Pramoxine hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material, AC1LAODB, 4-[3-(4-butoxyphenoxy)propyl]morpholin-4-ium chloride, AC1LCW6O, AKOS026749901, 4-[3-(4-butoxyphenoxy)propyl]morpholine; hydron; chloride


ID: 2160

chemical graph of compound 2160



InChIKey: SYDNPHFWTKACIZ-QXUFBKIYSA-N
SMILES: C1=CC=C(C=C1)/C=C/C(=O)C2=C(C=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6857762
synonyms found at PubChem are:
2',4'-DIHYDROXYCHALCONE 4'-GLUCOSIDE, Spectrum5_000572, AC1OAH67, BSPBio_001663, SPECTRUM200258, CHEMBL3039237, HMS1922P20, CCG-38691, SDCCGMLS-0066449.P001, NCGC00179105-01, 4'-(beta-D-Glucopyranosyloxy)-2'-hydroxychalcone, SR-05000002642, SR-05000002642-1, BRD-K55250255-001-02-8, BRD-K55250255-001-03-6, (E)-1-[2-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-phenylprop-2-en-1-one


ID: 2161

chemical graph of compound 2161



InChIKey: SYRURBPRFQUYQS-RHEJLWEFSA-N
SMILES: C1=CC(=C(C=C1/C=C\2/C(=O)C3=C(O2)C(=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 6450184
synonyms found at PubChem are:
Maritimein, 490-54-0, UNII-4PTU0WDQ7M, Maritimetin-6-O-glucoside, 4PTU0WDQ7M, EINECS 207-712-2, AC1O517A, SCHEMBL1706306, CHEMBL2165570, ZX-AFC002767, ZINC33985284, VA11236, (Z)-2-((3,4-Dihydroxyphenyl)methylene)-6-(beta-D-glucopyranosyloxy)-7-hydroxybenzofuran-3(2H)-one, 3',4'6,7-Tetrahydroxy-6-O-glucosylaurone, 3',4',6,7-Tetrahydroxy-6-O-glucosylaurone, J3.585.376F, 6-O-beta-D-Glucopyranosyl-3',4',6,7-tetrahydroxyaurone, 6-(beta-D-Glucopyranosyloxy)-7-hydroxy-2-(3,4-dihydroxybenzylidene)-3(2H)-benzofuranone, (2Z)-2-(3,4-dihydroxybenzylidene)-7-hydroxy-3-oxo-2,3-dihydro-1-benzofuran-6-yl beta-D-glucopyranoside, (2Z)-2-[(3,4-dihydroxyphenyl)methylidene]-7-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-3-one, 2-[1-(3,4-Dihydroxy-phenyl)-meth-(Z)-ylidene]-7-hydroxy-6-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-benzofuran-3-one, 3(2H)-benzofuranone, 2-[(3,4-dihydroxyphenyl)methylene]-6-(beta-D-glucopyranosyloxy)-7-hydroxy-, (2Z)-, 3(2H)-Benzofuranone,2-[(3,4-dihydroxyphenyl)methylene]-6-(b-D-glucopyranosyloxy)-7-hydroxy-, (2Z)-


ID: 2162

chemical graph of compound 2162



InChIKey: SYTBZMRGLBWNTM-UHFFFAOYSA-N
SMILES: CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3394
synonyms found at PubChem are:
flurbiprofen, 5104-49-4, Ansaid, Froben, Antadys, Cebutid, Flurofen, Anside, Flurbiprofene, Flurbiprofeno, Flurbiprofenum, Flubiprofen, Flugalin, Adofeed, 3-Fluoro-4-phenylhydratropic acid, Ocufen, 2-(2-fluorobiphenyl-4-yl)propanoic acid, Flurbiprofene [INN-French], Flurbiprofenum [INN-Latin], Flurbiprofeno [INN-Spanish], BTS 18322, Fluriproben, 2-(3-fluoro-4-phenylphenyl)propanoic acid, Ocuflur, Stayban, Zepolas, Adfeed, Novo-Flurprofen, Nu-Flurbiprofen, Apo-Flurbiprofen, Froben Sr, FP 70, BTS-18322, Anmetarin, Yakuban, U-27182, (+-)-2-Fluoro-alpha-methyl-4-biphenylacetic acid, 2-Fluoro-alpha-methyl-(1,1'-biphenyl)-4-acetic acid, Ansaid (TN), CCRIS 3708, U 27182, 2-(2-Fluorobiphenyl-4-yl)propionic Acid, C15H13FO2, Flurbiprofen [USAN:INN:BAN:JAN], EINECS 225-827-6, IN1332, (+-)-2-(2-Fluoro-4-biphenylyl)propionic acid, CHEMBL563, [+/-]-2-Fluoro-alpha-methyl-4-biphenylacetic acid, U 27,182, (+/-)-FLURBIPROFEN, 2-(2-Fluoro-4-biphenylyl)propionic acid, S-Flurbiprofen, MLS000040873, CHEBI:5130, MKS-11, 2-Fluoro-alpha-methyl-4-biphenylacetic acid, 2-(2-FLUORO-[1,1'-BIPHENYL]-4-YL)PROPANOIC ACID, SYTBZMRGLBWNTM-UHFFFAOYSA-N, (+/-)-2-Fluoro-alpha-methyl-4-biphenylacetic acid, L-790,330, (1)-2-Fluoro-alpha-methyl(1,1'-biphenyl)-4-acetic acid, (1,1'-Biphenyl)-4-acetic acid, 2-fluoro-alpha-methyl-, SMR000042823, 2-(3-fluoro-4-phenyl-phenyl)propanoic acid, F0371, 4-Biphenylacetic acid, 2-fluoro-alpha-methyl-, DSSTox_CID_17231, DSSTox_RID_79310, DSSTox_GSID_37231, Flurwood, Urbifen, AO-295/42284050, 2-(2-fluoro-[1,1'-biphenyl-4-yl])propanoic acid, Q-201129, (1,1'-Biphenyl)-4-acetic acid, 2-fluoro-alpha-methyl-, (+-)-, (+/-)-2-Fluoro-alpha-methyl[1,1&prime;-biphenyl]-4-acetic Acid, Flurbiprofen (Ansaid), CPD000042823, SR-01000003043, FLP, [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-alpha-methyl-, fluribiprofen, fluroben, 2-FLUORO-ALPHA-METHYL-[1,1'-BIPHENYL]-4-ACETIC ACID, dl-Flurbiprofen, Flurbiprofen O, rac-Flurbiprofen, Flurbiprofen,(S), NCGC00016654-01, CAS-5104-49-4, EINECS 257-262-6, Flurbiprofen(Ansaid), Froben (TN), Ocufen (Salt/Mix), FLURBIPROPHEN, Flurbiprofen [USAN:USP:INN:BAN:JAN], PubChem19809, Spectrum_001096, Opera_ID_777, AC1Q1LGF, Prestwick0_000917, Prestwick1_000917, Prestwick2_000917, Prestwick3_000917, Spectrum2_001025, Spectrum3_000435, Spectrum4_000558, Spectrum5_000720, (.+/-.)-Flurbiprofen, D0A1PX, AC1L1FU5, SCHEMBL2248, flurbiprofen and U-27182, 4-Biphenylacetic acid, 2-fluoro-.alpha.-methyl-, BSPBio_000794, BSPBio_002050, KBioGR_001255, KBioSS_001576, MLS000028441, MLS000758198, MLS001201729, MLS001401361, MLS006011431, MLS006011931, DivK1c_000804, SPECTRUM1500308, SPBio_001209, SPBio_002983, BPBio1_000874, GTPL4194, DTXSID0037231, SCHEMBL10029029, Flurbiprofen (JP15/USP/INN), Flurbiprofen (JP17/USP/INN), HMS502I06, KBio1_000804, KBio2_001576, KBio2_004144, KBio2_006712, KBio3_001270, SYTBZMRGLBWNTM-UHFFFAOYSA-, [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-.alpha.-methyl-, MolPort-000-812-253, NINDS_000804, SYNQUEST 2721-3-Y4, HMS1570H16, HMS1920O20, HMS2051A05, HMS2090I06, HMS2091F21, HMS2097H16, HMS2232I08, HMS3259I12, HMS3268E10, HMS3370N14, HMS3371I05, HMS3393A05, HMS3649K11, HMS3655G19, HMS3714H16, Pharmakon1600-01500308, BCP09086, BCP13426, KS-00000G9R, ZX-AP003721, Tox21_110547, Tox21_302353, BBL010980, BDBM50074922, BG0609, CCG-40243, GA8630, MFCD00079303, NSC685701, NSC757037, PC5245, SBB067242, STK802101, Flurbiprofen, cyclooxygenase inhibitor, AKOS004119934, AKOS016340701, AC-8106, AF10210, AN-8337, API0007620, BTS 18,322, CCG-100759, CS-2208, DB00712, KS-5035, MCULE-4306860727, NC00009, NC00563, NSC-685701, NSC-757037, RL03877, TRA0091146, 2(2-Fluoro-4-biphenylyl)propionic acid, IDI1_000804, NCGC00018157-03, NCGC00018157-04, NCGC00018157-05, NCGC00018157-08, NCGC00018157-11, NCGC00025287-03, NCGC00025287-04, NCGC00255457-01, 51543-38-5, AK163084, BC203869, CC-28514, H523, HY-10582, KB-51897, LS-44091, NCI60_030812, SAM001246961, SAM002564209, SC-12072, (+/-)-2-Fluoro-alpha-methyl[1,1&prime, 2 -(2-fluoro-4-biphenylyl)propionic acid, 2-(2-fluoro-4-biphenylyl)-propionic acid, 2-(2-fluoro-biphenyl-4-yl)propionic acid, SBI-0051387.P003, AB0013094, AB1010910, AX8130642, 2-(2-fluoro-biphenyl-4-yl)-propionic acid, AB00051999, FT-0603668, ST24047217, ST50825909, alpha-methyl-2-fluoro-4-biphenylylacetic acid, (RS)-2-(2-fluorobiphenyl-4-yl)propionic acid, 2-Fluoro-.alpha.-methyl-4-biphenylacetic acid, BIM-0051387.0001, C07013, D00330, J10166, K-9414, 2-(2-FLUORO-4-BIPHENYLYL)PROPANOIC ACID, AB00051999-17, AB00051999_18, 104F494, 2-(2-Fluoro[1,1'-biphenyl]-4-yl)propanoic acid, 2-fluoro--methyl-(1,1'-biphenyl)-4-acetic acid, C-14802, (.+/-.)-2-(2-Fluoro-4-biphenylyl)propionic acid, (r/s)-2-fluoro-alpha-methyl-4-biphenylacetic acid, [1,1'-Biphenyl]-4-aceticacid, 2-fluoro-a-methyl-, 2-Fluoro-?-methyl-[1,1'-biphenyl]-4-acetic acid, Flurbiprofen, Antibiotic for Culture Media Use Only, SR-01000003043-2, SR-01000003043-5, SR-01000003043-6, U-27,182, (RS)-2-(2-FLUORO-4-BIPHENYLYL)PROPIONIC ACID, 2-(2-fluoro-[1,1''-biphenyl-4-yl])propanoic acid, 2-(2-Fluoro[1,1'-biphenyl]-4-yl)propanoic acid #, BRD-A86044036-001-05-9, Flurbiprofen,2-(2-Fluorobiphenyl-4-yl)propanoic acid, I14-60958, SR-01000003043-14, (.+/-.)-2-Fluoro-.alpha.-methyl-4-biphenylacetic acid, 2-Fluoro-.alpha.-methyl(1,1'-biphenyl)-4-acetic acid, 2-fluoro-alpha-methyl-(1,1''-biphenyl)-4-acetic acid, 2-FLUORO-[1,1'-BIPHENYL]-4-(ALPHA-METHYL)ACETIC ACID, Flurbiprofen, European Pharmacopoeia (EP) Reference Standard, (+/-)-2-FLUORO-ALPHA-METHYL[1,1'-BIPHENYL]-4-ACETIC ACID, (1,1'-Biphenyl)-4-acetic acid, 2-fluoro-alpha-methyl-, (+/-)-, Flurbiprofen, United States Pharmacopeia (USP) Reference Standard, [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-.alpha.-methyl-, (.+/-.)-, Flurbiprofen, Pharmaceutical Secondary Standard; Certified Reference Material, InChI=1/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18)


ID: 2163

chemical graph of compound 2163



InChIKey: SZBULDQSDUXAPJ-XNIJJKJLSA-N
SMILES: C1CCC(CC1)NC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 9841284
synonyms found at PubChem are:
N6-Cyclohexyladenosine, 36396-99-3, N(6)-Cyclohexyladenosine, (2R,3R,4S,5R)-2-(6-(Cyclohexylamino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol, C16H23N5O4, Adenosine, N-cyclohexyl-, CHEMBL45891, (2R,3R,4S,5R)-2-[6-(cyclohexylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol, n-cyclohexyladenosine, N-6-cyclohexyladenosine, N6 -cyclohexyladenosine, N6-Cyclohexylado (CHA), D02JCM, n6-cyclohexyl[3h]adenosine, Lopac0_000331, GTPL423, SCHEMBL145856, MolPort-027-835-536, SZBULDQSDUXAPJ-XNIJJKJLSA-N, HMS3261C03, ZINC4217017, Tox21_500331, 4616AB, BDBM50009552, MFCD00036808, PDSP1_000670, PDSP1_001023, PDSP1_001025, PDSP2_000660, PDSP2_001007, PDSP2_001009, AKOS016009588, CCG-204426, CS-5050, LP00331, NCGC00093771-01, NCGC00093771-02, NCGC00093771-03, NCGC00093771-04, NCGC00261016-01, AC-27401, AJ-48997, HY-18939, AX8142876, KB-206469, EU-0100331, ST24026156, C 9901, SR-01000075797, SR-01000075797-1, 2-[6-Amino-2-(2-morpholin-4-yl-ethylamino)-purin-9-yl]-5-hydroxymethyl-tetrahydro-furan-3,4-diol


ID: 2164

chemical graph of compound 2164



InChIKey: SZINUGQCTHLQAZ-DQYPLSBCSA-N
SMILES: CC(=O)C1=C([C@@H]2[C@@H]3[C@@H](CC4=C5C3=CNC5=CC=C4)C(N2C1=O)(C)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 54682463
synonyms found at PubChem are:
cyclopiazonic acid, alpha-Cyclopiazonic acid, 18172-33-3, UNII-X9TLY4580Z, NSC 117181, CCRIS 4942, HSDB 7248, alpha-Cyclopiazonate, X9TLY4580Z, CHEBI:22450, 83136-88-3, C20H20N2O3, cyclopyazonic acid, (6aR,10Z,11aS,11bR)-10-(1-hydroxyethylidene)-7,7-dimethyl-6a,7,11a,11b-tetrahydro-6H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indole-9,11(2H,10H)-dione, 9H-Pyrrolo(1',2':2,3)isoindolo(4,5,6-cd)indol-9-one, 2,6,6a,7,11a,11b-hexahydro-10-acetyl-7,7-dimethyl-11-hydroxy-, (6a-alpha,11a,11b-alpha)-, (6ar,11as,11br)-10-Acetyl-9-Hydroxy-7,7-Dimethyl-2,6,6a,7,11a,11b-Hexahydro-11h-Pyrrolo[1',2':2,3]isoindolo[4,5,6-Cd]indol-11-One, 2o9j, 2oa0, D0K6HL, AC1L22XA, BSPBio_001303, CHEMBL480627, GTPL5350, SCHEMBL1471247, SCHEMBL15049041, CHEBI:17734, MolPort-003-983-745, HMS1791B05, HMS1989B05, HMS3267F17, HMS3402B05, BS0055, MFCD00167445, AKOS024456479, ZINC100061481, ZINC100067111, ZINC110970687, CCG-208182, DB07604, NCGC00163130-01, NCGC00163130-02, NCGC00163130-03, LS-139391, FT-0624278, C03032, J-011619, (2R,3S,9R)-5-acetyl-4-hydroxy-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0^{2,9}.0^{3,7}.0^{15,18}]octadeca-1(17),4,11(18),12,14-pentaen-6-one, (2R,3S,9R)-5-acetyl-6-hydroxy-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0^{2,9}.0^{3,7}.0^{15,18}]octadeca-1(17),5,11(18),12,14-pentaen-4-one, (6aR,11aS,11bR)-10-acetyl-11-hydroxy-7,7-dimethyl-2,6,6a,7,11a,11b-hexahydro-9H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one, (6aR,11aS,11bR)-rel-10-Acetyl-2,6,6a,7,11a,11b-hexahydro-7,7-dimethyl-9H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one, 98718-32-2, 9H-Pyrrolo(1',2':2,3)isoindolo(4,5,6-cd)indol-9-one, 10-acetyl-2,6,6a,7,11a,11b-hexahydro-11-hydroxy-7,7-dimethyl-, (6aalpha,11abeta,11balpha)- (8CI), 9H-Pyrrolo(1',2':2,3)isoindolo(4,5,6-cd)indol-9-one, 10-acetyl-2,6,6a,7,11a,11b-hexahydro-11-hydroxy-7,7-dimethyl-, (6aalpha,11abeta,11balpha)- (8CI)(9CI), 9H-Pyrrolo(1',2':2,3)isoindolo(4,5,6-cd)indol-9-one, 10-acetyl-2,6,6a,7,11a,11b-hexahydro-11-hydroxy-7,7-dimethyl-, (6aR,11aS,11bR)-rel-


ID: 2165

chemical graph of compound 2165



InChIKey: SZLZWPPUNLXJEA-QEGASFHISA-N
SMILES: CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)/C=C/C6=CC(=C(C(=C6)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5280954
synonyms found at PubChem are:
rescinnamine, Rescinnamin, Moderil, Cinnaloid, Rescisan, Resealoid, Scinnamina, Apoterin, Anaprel, Cartric, 24815-24-5, Cinnasil, Paresinan, Raurescin, Apolon, Rozex, Reserpinine, Normorescina, Cinamine, Cinatabs, Raupyrol, Raurescine, Recitensina, Rescaloid, Rescamin, Rescidan, Rescinpal, Rescitens, Reskinnamin, Tenamine, Rescin, Resipal, Tuareg, Methyl trimethoxycinnamoylreserpate, Reserpinine (C35 alkaloid), Reserpinine (VAN), Rescinamina, Rescinnamina, Rescinnamine (VAN), Rescinnaminum, Rescinnamina [DCIT], Rescinamina [INN-Spanish], Rescinnaminum [INN-Latin], Resepinine (C35 alkaloid), Recinnamine, Reserpinene, Reserpinin, Tsuruselpi S, 3,4,5-Trimethoxycinnamoyl methyl reserpate, UNII-Q6W1F7DJ2D, Rescinnamine [BAN:INN:JAN], Trimethoxy cinnamoyl reserpate de methyl, CCRIS 4711, Tsuruselpi S (TN), 3,4,5-Trimethylcinnamoyl methyl reserpate, HSDB 2176, 3,4,5-Trimethylcinnamic acid, ester with methyl reserpate, NSC15628, EINECS 246-471-8, Rescinnamine (JAN/INN), NSC 15628, 3,4,5-Trimethoxycinnamic acid, methyl reserpate, Trimethoxy cinnamoyl reserpate de methyl [French], Methyl 18-O-(3,4,5-trimethoxycinnamoyl)reserpate, BRN 0075328, Q6W1F7DJ2D, Methyl reserpate 3,4,5-trimethoxycinnamic acid ester, AI3-52763, CHEBI:28572, Trimethoxycinnamoyl methyl reserpate, Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)-, Anapral, 11,17alpha-Dimethoxy-18beta-((1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)oxy)-3beta,20alpha-yohimban-16beta-carboxylic acid methyl ester, 3beta,20alpha-Yohimban-16beta-carboxylic acid, 18beta-hydroxy-11,17alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester), (E)-, Methyl 1alpha,2beta,3alpha,4,4aalpha,5,7,8,13,13bbeta,14,14aalpha-dodecahydro-2alpha,11-dimethoxy-3beta-(3,4,5-trimethoxycinnamoyloxy)benz(g)indolo(2,3-a)quinolizine-1beta-carboxylate, Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)-oxy)-, methyl ester, (3beta,16beta,17alpha,18beta(E),20alpha)-, Reserpic acid methyl ester 3,4,5-trimethoxycinnamate, Apoterin S, O-(3,4,5-Trimethoxy-trans-cinnamoyl) methyl reserpate, Methyl 18beta-hydroxy-11,17alpha-dimethoxy-3beta,20alpha-yohimban-16beta-carboxylate, 3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 18-beta-hydroxy-11,17-alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester), 3beta,20alpha-Yohimban-16beta-carboxylic acid, 18beta-hydroxy-11,17alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester), methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate, Rescinnamine [INN:BAN:JAN:NF], Cinnasil (TN), methyl (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-({(2E)-3-[3,4,5-tris(methyloxy)phenyl]prop-2-enoyl}oxy)yohimban-16-carboxylate, Prestwick_558, Anaprel (TN), Moderil (TN), Prestwick2_000568, Prestwick3_000568, D0G8NJ, CHEMBL1668, BSPBio_000356, 4-25-00-01323 (Beilstein Handbook Reference), MLS002153878, SCHEMBL181966, BPBio1_000392, GTPL7098, MEGxp0_001952, ACon1_002115, CHEBI:92923, MolPort-001-742-634, C35H42N2O9, HMS1569B18, HMS2096B18, HMS2234E08, ZINC4097185, NSC-15628, LS-1060, 3,5-Trimethoxycinnamoyl methyl reserpate, NCGC00179585-04, SMR001233232, NP-011016, 3,5-Trimethoxycinnamic acid, methyl reserpate, C06540, D00198, NCGC00179585-04_C35H42N2O9_Cinnaloid, BRD-K52930707-001-02-2, BRD-K52930707-001-04-8, 11,17-Dimethoxy-18-[[1-oxo-3-3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-3,20-yohimban-16-carboxylic acid methyl ester, 15676-43-4, 15676-44-5, 25460-29-1, 28821-79-6, 3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 18-beta-hydroxy-11,17-alpha-dimethoxy-,methyl ester, 3,4,5-trimethoxycinnamate (ester), 3.beta., 18.beta.-hydroxy-11,17.alpha.-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester), 412909-15-0, 522-78-1, 84-34-4, Benz[g]indolo[2, 1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydro-3-hydroxy-2,11-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate, methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-{[3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-3,13-diazapentacyclo[11.8.0.0;{2,10}.0;{4,9}.0;{15,20}]henicosa-2(10),4,6,8-tetraene-19-carboxylate, methyl 11,17alpha-dimethoxy-18beta-{[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-3beta,20alpha-yohimban-16beta-carboxylate, Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-(((2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)-, Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-[[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-, methyl ester, (3b,16b,17a,18b,20a)-, Yohimban-16-carboxylic acid,17-dimethoxy-18-[[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-, methyl ester, (3.beta.,16.beta.,17.alpha.,18.beta.,20.alpha.)-, Yohimban-16-carboxylicacid,11,17-dimethoxy-18-[[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propen-1-yl]oxy]-,methyl ester, (3b,16b,17a,18b,20a)-


ID: 2166

chemical graph of compound 2166



InChIKey: SZNLKILVMCHHSD-OZFNKYQOSA-N
SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/C(=O)O)/C)/C)/C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5275521
synonyms found at PubChem are:
Geranylgeranic acid, Geranylgeranoic acid, CHEBI:84971, 83807-40-3, (2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenoic acid, AC1NQN4U, 3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenoic acid, SCHEMBL430557, CHEMBL171326, SCHEMBL16221387, SZNLKILVMCHHSD-OZFNKYQOSA-N, (2E,6E,10E)-geranylgeranic acid, AKOS027326390, CCG-208213, NCGC00163653-01, SR-05000002342, SR-05000002342-2, 2,6,10,14-Hexadecatetraenoic acid, 3,7,11,15-tetramethyl-, 2,6,10,14-Hexadecatetraenoic acid, 3,7,11,15-tetramethyl-, (2E,6E,10E)-, 35750-48-2


ID: 2167

chemical graph of compound 2167



InChIKey: SZQIFWWUIBRPBZ-UHFFFAOYSA-N
SMILES: CCN1C(=O)C(NC1=O)C2=CC=CC=C2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 3292
synonyms found at PubChem are:
ethotoin, Peganone, 86-35-1, Ethotoinum, 3-Ethyl-5-phenylhydantoin, Ethotoine, Etotoina, 3-ethyl-5-phenylimidazolidine-2,4-dione, Accenon, Ethotoine [INN-French], Ethotoinum [INN-Latin], Etotoina [INN-Spanish], Pegoanone, 3-Ethyl-5-phenylimidazolidin-2,4-dione, 1-Ethyl-2,5-dioxo-4-phenylimidazolidine, 2,4-Imidazolidinedione, 3-ethyl-5-phenyl-, Hydantoin, 3-ethyl-5-phenyl-, (+-)-3-Ethyl-5-phenylhydantoin, Ethotoin [INN:BAN:JAN], Peganone (TN), Accenon (TN), HSDB 3580, EINECS 201-665-1, Ethotoin (JAN/USP/INN), BRN 0188272, CHEBI:4888, 3-Ethyl-5-phenyl-2,4-imidazolidinedione, 3-ethyl-5-phenyl-imidazolidine-2,4-dione, 2,4-Imidazolidinedione, 3-ethyl-5-phenyl-, (+-)-, Ethotoin [USP:INN:BAN:JAN], CAS-86-35-1, NCGC00016340-01, Abbott brand of ethotoin, AC1L1FLQ, (.+/-.)-Ethotoin, Prestwick0_000696, Prestwick1_000696, Prestwick2_000696, Prestwick3_000696, DSSTox_CID_3020, D05EPM, CHEMBL1095, DSSTox_RID_76833, DSSTox_GSID_23020, Oprea1_374844, SCHEMBL34301, BSPBio_000851, 5-24-08-00005 (Beilstein Handbook Reference), MLS002153961, SPBio_002772, BPBio1_000937, GTPL7183, DTXSID6023020, MolPort-003-666-682, SZQIFWWUIBRPBZ-UHFFFAOYSA-N, HMS1570K13, HMS2097K13, HMS2232M06, HMS3371O03, HMS3714K13, Pharmakon1600-01505428, Tox21_110383, NSC760074, AKOS008947805, API0009008, CCG-213433, DB00754, MCULE-6544505383, NSC-760074, NCGC00179401-01, NCGC00179401-03, LS-76194, NS-02146, SMR001233300, 3-Ethyl-5-phenyl-2,4-imidazolidinedione #, AB00513897, C07839, D00708, AB00513897_07, SR-01000841832, SR-01000841832-2, Z53845223, 1-ethyl-2-hydroxy-4-phenyl-4,5-dihydro-1H-imidazol-5-one


ID: 2168

chemical graph of compound 2168



InChIKey: SZUJJDLBXJCDNT-AQNXPRMDSA-N
SMILES: CCCCCCCCCCCCCC[C@H]([C@H]([C@@H](CO)NC(=O)C)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 10451108
synonyms found at PubChem are:
C2 Phytoceramide, 475995-69-8, CTK8E7779, RT-011877, (2R,3S,4R)-2-(Acetylamino)octadecane-1,3,4-triol


ID: 2169

chemical graph of compound 2169



InChIKey: TTYVYRHNIVBWCB-UHFFFAOYSA-N
SMILES: CC1CCC(C(C1)OC(=O)C2=CC=CC=C2)C(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 93868
synonyms found at PubChem are:
71617-14-6, TTYVYRHNIVBWCB-UHFFFAOYSA-N, MENTHYL BENZOATE, (5-methyl-2-propan-2-ylcyclohexyl) benzoate, (-)-Menthyl benzoate, 58641-29-5, 6284-35-1, menthylbenzoat, benzoic acid,(-)-menthyl ester, Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1-benzoate, (1R,2S,5R)-rel-, Cyclohexanol, 5-methyl-2-(1-methylethyl)-, benzoate, (1R,2S,5R)-rel-, 38649-18-2, EINECS 228-505-3, EINECS 261-374-0, EINECS 275-706-7, 2-(Isopropyl)-5-methylcyclohexyl benzoate, 2-5-methylcyclohexylbenzoate, AC1L3R22, AC1Q60U6, SCHEMBL3885473, CTK5B6321, Benzoic acid, (-)-menthyl ester, Benzoic acid p-menthane-3-yl ester, (1S-(1alpha,2beta,5alpha))-2-(Isopropyl)-5-methylcyclohexyl benzoate, Cyclohexanol, 5-methyl-2-(1-methylethyl)-, benzoate, [1R-(1.alpha.,2.beta.,5.alpha.)]-, 2-Isopropyl-5-methylcyclohexyl benzoate #, (2-isopropyl-5-methyl-cyclohexyl) benzoate, Cyclohexanol,5-methyl-2-(1-methylethyl)-, 1-benzoate, (1R,2S,5R)-


ID: 2170

chemical graph of compound 2170



InChIKey: TTZDOBVWBQXGDC-KPKJPENVSA-N
SMILES: C1=CC=C2C(=C1)C(=CN2)/C=C(\C#N)/C(=O)C3=CC(=C(C=C3)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5329275
synonyms found at PubChem are:
Tyrphostin AG 808, NSC650934, AG-808, (E)-2-(3,4-dihydroxybenzoyl)-3-(1H-indol-3-yl)prop-2-enenitrile, Tryphostin AG 808, Tyrphostin AG-808, AC1NS6FZ, AC1Q4QHJ, Lopac-T-5318, Lopac0_001178, CHEMBL68534, Indole-Containing Inhibitor 5, BDBM5171, Tyrphostin AG 808, >=98%, ZINC3927328, IN1964, CCG-205252, NSC-650934, 2-Propenenitrile,4-dihydroxy- benzoyl)-, NCGC00016030-01, NCGC00016030-02, NCGC00016030-03, NCGC00016030-04, NCGC00094433-01, NCGC00094433-02, EU-0101178, T 5318, SR-01000076162, SR-01000076162-1, 2-(3,4-Dihydroxybenzoyl)-3-(1H-indol-3-yl)acrylonitrile, 2-Propenenitrile, 3-(1H-indol-3-yl)-2-(3,4-dihydroxy- benzoyl)-, 2-Cyano-3-(3',4'-dihydroxyphenyl)-1-(3"-indolyl)-3-oxo-1-propene, (2E)-2-[(3,4-dihydroxyphenyl)carbonyl]-3-(1H-indol-3-yl)prop-2-enenitrile, 2-Cyano-3-(3 inverted exclamation marka,4 inverted exclamation marka-dihydroxyphenyl)-1-(3 inverted exclamation marka-indolyl)-3-oxo-1-propene


ID: 2171

chemical graph of compound 2171



InChIKey: TUCIOBMMDDOEMM-RIYZIHGNSA-N
SMILES: C1=CC=C(C=C1)CNC(=O)/C(=C/C2=CC(=C(C=C2)O)O)/C#N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"GW Carlile" "J Goepp" "J Liao" "D Rotin" "R Robert" "JW Hanrahan" "DY Thomas" "E Matthes" "B Kus" "SD Macknight"


CID is 5328779
synonyms found at PubChem are:
AG-490, 133550-30-8, Tyrphostin B42, AG 490, Tyrphostin AG 490, AG490, (E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)acrylamide, Tyrphostin AG490, tyrphostin AG-490, alpha-Cyano-(3,4-dihydroxy)-N-benzylcinnamide, AG-490 (Tyrphostin B42), N-Benzyl-2-cyano-3-(3,4-dihydroxyphenyl)acrylamide, (2E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide, 134036-52-5, CHEMBL56543, (E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide, (2E)-2-CYANO-3-(3,4-DIHYDROXYPHENYL)-N-(PHENYLMETHYL)-2-PROPENAMIDE, (E)-2-CYANO-3-(3,4-DIHYDROPHENYL)-N-(PHENYLMETHYL)-2-PROPENAMIDE, 2-PROPENAMIDE, 2-CYANO-3-(3,4-DIHYDROXYPHENYL)-N-(PHENYLMETHYL)-, (2E)-, SMR001230665, SR-01000076153, 2-Cyano-3-(3,4-dihydroxyphenyl)-N-(phenylmethyl)-2-propenamide, n-benzyl-3,4-dihydroxy-benzylidenecyanoacetamide, Tyrphostin,AG490, N-Benzyl-3,4-dihydroxy-alpha-cyanocinnamide, Tocris-0414, Tyrphostin deriv. 42, AC1NS5BM, BiomolKI_000025, Lopac-T-3434, BiomolKI2_000033, D0FY0R, D0GZ7B, Tyrphostin AG 490, solid, Lopac0_001166, SCHEMBL93682, BMK1-D1, BSPBio_001396, MLS002153172, MLS006011256, BDBM4313, GTPL5916, DTXSID5040960, NOCAS_40960, AOB6474, EX-A118, EX-A464, CHEBI:131968, MolPort-001-761-274, BCPP000424, HMS1361F18, HMS1791F18, HMS1989F18, HMS2231N13, HMS3229M15, HMS3402F18, ZINC25579