CFam Chemical Families Database
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You are searching for "CFAMM00475190" in compound.

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CFAM Mol ID CFAMM00475190
Family CFFBM25624 Caspase-3 and Caspase-7 inhibitor AGN-PC-00BUR6 family
Superfamily CFSBM10046 Caspase-3 and Caspase-7 Binder Superfamily 5
Class CFCID325 Class 1675
External ID CHEMBL202971 External Source CHEMBL
PubChem CID 11572844 Functional Category Bioactive
Molecule Name AGN-PC-00BUR6
IUPAC Name 4-oxo-4-[(1,3,4-trioxoisoquinolin-6-yl)amino]butanoic acid
Synonyms SureCN13442874;Isoquinoline-1,3,4-trione 12a;4-oxo-4-[(1,3,4-trioxoisoquinolin-6-yl)amino]butanoic acid
InChi InChI=1S/C13H10N2O6/c16-9(3-4-10(17)18)14-6-1-2-7-8(5-6)11(19)13(21)15-12(7)20/h1-2,5H,3-4H2,(H,14,16)(H,17,18)(H,15,20,21)
InChiKey RZIOHTDLDUFVCW-UHFFFAOYSA-N
Formula C13H10N2O6 Molecular Weight 290.23
Cross Link CHEMBL202971
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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