CFam Chemical Families Database
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You are searching for "CFAMM00109708" in compound.

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CFAM Mol ID CFAMM00109708
Family CFFAD880 Aldehyde oxidase Inhibitor Isovanillin Family
Superfamily CFSAD739 Aldehyde oxidase Inhibitor Isovanillin Superfamily
Class CFCAD663 Class 663
External ID CHEMBL176696 External Source CHEMBL
PubChem CID 10647020 Functional Category Bioactive
Molecule Name (Z)-2-(1,3-benzodioxol-5-yl)-3-benzyl-4-(3,4-dimethoxyphenyl)-4-oxobut-2-enoic acid
IUPAC Name (Z)-2-(1,3-benzodioxol-5-yl)-3-benzyl-4-(3,4-dimethoxyphenyl)-4-oxobut-2-enoic acid
Synonyms CHEBI:394524
InChi InChI=1S/C26H22O7/c1-30-20-10-9-18(14-22(20)31-2)25(27)19(12-16-6-4-3-5-7-16)24(26(28)29)17-8-11-21-23(13-17)33-15-32-21/h3-11,13-14H,12,15H2,1-2H3,(H,28,29)/b24-19-
InChiKey OCBZLMNNBYZTON-CLCOLTQESA-N
Formula C26H22O7 Molecular Weight 446.45
Cross Link CHEMBL176696
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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