CFam Chemical Families Database
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You are searching for "CFAMM00530490" 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 CFAMM00530490
Family CFFBM47753 [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial and [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial inhibitor AGN-PC-074HDT family
Superfamily CFSBM2138 [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial and [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial Binder Superfamily
Class CFCBM823 Class 3873
External ID CHEMBL72149 External Source CHEMBL
PubChem CID 44312087 Functional Category Bioactive
Molecule Name AGN-PC-074HDT
IUPAC Name N-(3-benzoyl-2-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
Synonyms CHEBI:215513;N-(3-benzoyl-2-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
InChi InChI=1S/C17H13ClF3NO3/c1-16(25,17(19,20)21)15(24)22-12-9-5-8-11(13(12)18)14(23)10-6-3-2-4-7-10/h2-9,25H,1H3,(H,22,24)
InChiKey LHSKWVQEAJUPOG-UHFFFAOYSA-N
Formula C17H13ClF3NO3 Molecular Weight 371.74
Cross Link CHEMBL72149
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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