CFam Chemical Families Database
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You are searching for "CFAMM00378804" 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 CFAMM00378804
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 CHEMBL247000 External Source CHEMBL
PubChem CID 44442504 Functional Category Bioactive
Molecule Name SureCN3497650
IUPAC Name 3-[3-(1-ethyl-4,4,6-trimethyl-2-oxo-3H-quinolin-7-yl)-4-(trifluoromethoxy)phenyl]butanoic acid
Synonyms CHEBI:514628
InChi InChI=1S/C25H28F3NO4/c1-6-29-20-12-17(15(3)9-19(20)24(4,5)13-22(29)30)18-11-16(14(2)10-23(31)32)7-8-21(18)33-25(26,27)28/h7-9,11-12,14H,6,10,13H2,1-5H3,(H,31,32)
InChiKey PHRURZQTGOTHBJ-UHFFFAOYSA-N
Formula C25H28F3NO4 Molecular Weight 463.49
Cross Link CHEMBL247000
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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