CFam Chemical Families Database
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You are searching for "CFAMM00066274" in compound.

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CFAM Mol ID CFAMM00066274
Family CFFAD454 Cyclooxygenase Inhibitor Fenoprofen Family
Superfamily CFSAD393 Cyclooxygenase Inhibitor Fenoprofen Superfamily
Class CFCAD366 Class 366
External ID CHEMBL49302 External Source CHEMBL
PubChem CID 6444688 Functional Category Bioactive
Molecule Name LY-223982
IUPAC Name 3-[3-(2-carboxyethyl)-4-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]benzoyl]benzoic acid
Synonyms LY 233978 Disodium salt;3-{[3-(2-carboxyethyl)-4-{[(5E)-6-(4-methoxyphenyl)hex-5-en-1-yl]oxy}phenyl]carbonyl}benzoic acid;SureCN7202040;AC1O61A0;GTPL3371;GTPL3415;Cgs 23131;Skf 107324;CHEBI:172922
InChi InChI=1S/C30H30O7/c1-36-26-14-10-21(11-15-26)7-4-2-3-5-18-37-27-16-12-24(19-22(27)13-17-28(31)32)29(33)23-8-6-9-25(20-23)30(34)35/h4,6-12,14-16,19-20H,2-3,5,13,17-18H2,1H3,(H,31,32)(H,34,35)/b7-4+
InChiKey SYZSSLLFRVDRHL-QPJJXVBHSA-N
Formula C30H30O7 Molecular Weight 502.55
Cross Link CHEMBL49302
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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