CFam Chemical Families Database
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You are searching for "CFAMM00437600" in compound.

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CFAM Mol ID CFAMM00437600
Family CFFBM16277 5-hydroxytryptamine receptor 1A and 5-hydroxytryptamine receptor 1B ligand (5aS,6aR,9R)-7-methyl-9-(phenylsulfanylmethyl)-5,5a,6,6a,8,9-hexahydro-4H-indolo[4,3-fg]quinoline family
Superfamily CFSBM6808 Cytochrome P450 3A4 and Cytochrome P450 2C19 Binder Superfamily 3
Class CFCBM384 Class 3434
External ID CHEMBL36379 External Source CHEMBL
PubChem CID 14107796 Functional Category Bioactive
Molecule Name (5aS,6aR,9R)-7-methyl-9-(phenylsulfanylmethyl)-5,5a,6,6a,8,9-hexahydro-4H-indolo[4,3-fg]quinoline
IUPAC Name (5aS,6aR,9R)-7-methyl-9-(phenylsulfanylmethyl)-5,5a,6,6a,8,9-hexahydro-4H-indolo[4,3-fg]quinoline
Synonyms CHEBI:155058
InChi InChI=1S/C22H24N2S/c1-24-13-15(14-25-17-6-3-2-4-7-17)10-19-18-8-5-9-20-22(18)16(12-23-20)11-21(19)24/h2-10,15-16,21,23H,11-14H2,1H3/t15-,16-,21-/m1/s1
InChiKey OONDWRMFJIXGII-WHSLLNHNSA-N
Formula C22H24N2S Molecular Weight 348.50
Cross Link CHEMBL36379
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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