CFam Chemical Families Database
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You are searching for "CFAMM00109991" in compound.

Total 1 results found.

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 CFAMM00109991
Family CFFAD880 Aldehyde oxidase Inhibitor Isovanillin Family
Superfamily CFSAD739 Aldehyde oxidase Inhibitor Isovanillin Superfamily
Class CFCAD663 Class 663
External ID CHEMBL347667 External Source CHEMBL
PubChem CID 14997887 Functional Category Bioactive
Molecule Name SureCN6936357
IUPAC Name 6-hydroxy-5-methoxy-2-methyl-2,3-dihydroinden-1-one
Synonyms AGN-PC-003A5M;CHEBI:357532;1H-Inden-1-one, 2,3-dihydro-6-hydroxy-5-methoxy-2-methyl-
InChi InChI=1S/C11H12O3/c1-6-3-7-4-10(14-2)9(12)5-8(7)11(6)13/h4-6,12H,3H2,1-2H3
InChiKey WHEBWOWRTSFQQO-UHFFFAOYSA-N
Formula C11H12O3 Molecular Weight 192.21
Cross Link CHEMBL347667
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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