CFam Chemical Families Database
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You are searching for "CFAMM00394554" in compound.

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CFAM Mol ID CFAMM00394554
Family CFFBM9335 Prostaglandin E2 receptor EP4 subtype and Prostaglandin E2 receptor EP2 subtype ligand 4-[2-[(2R)-2-[(E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]but-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]butanoic acid family
Superfamily CFSBM2782 Prostaglandin E2 receptor EP4 subtype and Prostaglandin E2 receptor EP3 subtype Binder Superfamily
Class CFCBM1084 Class 4134
External ID CHEMBL1929527 External Source CHEMBL
PubChem CID 56834112 Functional Category Bioactive
Molecule Name 4-[2-[(2R)-2-[(E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]but-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]butanoic acid
IUPAC Name 4-[2-[(2R)-2-[(E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]but-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]butanoic acid
Synonyms SureCN11929380
InChi InChI=1S/C22H31NO5S/c1-28-16-18-5-2-4-17(14-18)15-20(24)9-7-19-8-10-21(25)23(19)11-13-29-12-3-6-22(26)27/h2,4-5,7,9,14,19-20,24H,3,6,8,10-13,15-16H2,1H3,(H,26,27)/b9-7+/t19-,20+/m0/s1
InChiKey CERPXAWHPJKQQI-QOEWUMFVSA-N
Formula C22H31NO5S Molecular Weight 421.55
Cross Link CHEMBL1929527
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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