CFam Chemical Families Database
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You are searching for "CFAMM00378796" in compound.

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CFAM Mol ID CFAMM00378796
Family CFFBM7292 Prostaglandin D2 receptor 2 ligand SureCN136287 family
Superfamily CFSBM4106 Aldose reductase and Prostaglandin D2 receptor 2 Binder Superfamily
Class CFCBM90 Class 3140
External ID CHEMBL428406 External Source CHEMBL
PubChem CID 44442516 Functional Category Bioactive
Molecule Name SureCN3496855
IUPAC Name 3-[4-methoxy-3-(4,4,6-trimethyl-2-oxo-1-propan-2-yl-3H-quinolin-7-yl)phenyl]propanoic acid
Synonyms CHEBI:514665
InChi InChI=1S/C25H31NO4/c1-15(2)26-21-13-18(16(3)11-20(21)25(4,5)14-23(26)27)19-12-17(8-10-24(28)29)7-9-22(19)30-6/h7,9,11-13,15H,8,10,14H2,1-6H3,(H,28,29)
InChiKey QXMUPBOLDWJSOO-UHFFFAOYSA-N
Formula C25H31NO4 Molecular Weight 409.52
Cross Link CHEMBL428406
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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