CFam Chemical Families Database
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You are searching for "CFAMM00317985" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00317985
Family CFFBM963 Prostaglandin E2 receptor EP3 subtype and Prostaglandin E2 receptor EP4 subtype ligand SureCN4488527 family
Superfamily CFSBM547 Beta-3 adrenergic receptor and Pol polyprotein Binder Superfamily
Class CFCAD630 Class 630
External ID CHEMBL414819 External Source CHEMBL
PubChem CID 10792682 Functional Category Bioactive
Molecule Name SureCN6774574
IUPAC Name (2S)-2-[[5-(cyclohexylmethyl)-2-(2-methylphenyl)-4-(pyridin-3-yloxymethyl)benzoyl]amino]-4-methylsulfanylbutanoic acid
Synonyms CHEBI:302112
InChi InChI=1S/C32H38N2O4S/c1-22-9-6-7-13-27(22)28-19-25(21-38-26-12-8-15-33-20-26)24(17-23-10-4-3-5-11-23)18-29(28)31(35)34-30(32(36)37)14-16-39-2/h6-9,12-13,15,18-20,23,30H,3-5,10-11,14,16-17,21H2,1-2H3,(H,34,35)(H,36,37)/t30-/m0/s1
InChiKey GRKXZEYMVZRROT-PMERELPUSA-N
Formula C32H38N2O4S Molecular Weight 546.72
Cross Link CHEMBL414819
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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