CFam Chemical Families Database
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You are searching for "CFAMM00265592" in compound.

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CFAM Mol ID CFAMM00265592
Family CFFID2331 Carbonic anhydrase 9 and Carbonic anhydrase 12 Inhibitor Ethoxycoumarin Family
Superfamily CFSID1705 Carbonic anhydrase 9 and Carbonic anhydrase 12 Binder Superfamily
Class CFCCD131 Class 944
External ID CHEMBL145452 External Source CHEMBL
PubChem CID 13309305 Functional Category Bioactive
Molecule Name (3,4-dimethyl-2-oxochromen-7-yl) 4-methoxybenzenesulfonate
IUPAC Name (3,4-dimethyl-2-oxochromen-7-yl) 4-methoxybenzenesulfonate
Synonyms AGN-PC-00LZQH;(3,4-dimethyl-2-oxochromen-7-yl) 4-methoxybenzenesulfonate
InChi InChI=1S/C18H16O6S/c1-11-12(2)18(19)23-17-10-14(6-9-16(11)17)24-25(20,21)15-7-4-13(22-3)5-8-15/h4-10H,1-3H3
InChiKey VBPNIRNKMDDCEE-UHFFFAOYSA-N
Formula C18H16O6S Molecular Weight 360.38
Cross Link CHEMBL145452
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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