CFam Chemical Families Database
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You are searching for "CFAMM00110010" in compound.

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CFAM Mol ID CFAMM00110010
Family CFFAD880 Aldehyde oxidase Inhibitor Isovanillin Family
Superfamily CFSAD739 Aldehyde oxidase Inhibitor Isovanillin Superfamily
Class CFCAD663 Class 663
External ID CHEMBL357646 External Source CHEMBL
PubChem CID 10072649 Functional Category Bioactive
Molecule Name 2,3-bis[(3,4,5-trihydroxybenzoyl)oxy]butanedioic acid
IUPAC Name 2,3-bis[(3,4,5-trihydroxybenzoyl)oxy]butanedioic acid
Synonyms CHEBI:346511
InChi InChI=1S/C18H14O14/c19-7-1-5(2-8(20)11(7)23)17(29)31-13(15(25)26)14(16(27)28)32-18(30)6-3-9(21)12(24)10(22)4-6/h1-4,13-14,19-24H,(H,25,26)(H,27,28)
InChiKey ISFQIUFDHRENTK-UHFFFAOYSA-N
Formula C18H14O14 Molecular Weight 454.30
Cross Link CHEMBL357646
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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