CFam Chemical Families Database
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You are searching for "CFAMM00530493" 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 CFAMM00530493
Family CFFBM47755 Potassium voltage-gated channel subfamily A member 3 ligand (E)-1-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-3-thiophen-2-ylprop-2-en-1-one family
Superfamily CFSBM10486 Beta-lactamase and Tumor necrosis factor receptor superfamily member 1A Binder Superfamily
Class CFCID776 Class 2126
External ID 57246825 External Source PubChem
PubChem CID 57246825 Functional Category Patent Compound
Molecule Name AGN-PC-0BQ9NO
IUPAC Name 5-tert-butyl-6-ethyl-4-hydroxy-3-methyl-7-(thiophene-2-carbonyl)-1-benzofuran-2-carboxylic acid
Synonyms 5-tert-butyl-6-ethyl-4-hydroxy-3-methyl-7-(thiophene-2-carbonyl)-1-benzofuran-2-carboxylic acid
InChi InChI=1S/C21H22O5S/c1-6-11-14(16(22)12-8-7-9-27-12)19-13(10(2)18(26-19)20(24)25)17(23)15(11)21(3,4)5/h7-9,23H,6H2,1-5H3,(H,24,25)
InChiKey BTBHJEPDKDUHBY-UHFFFAOYSA-N
Formula C21H22O5S Molecular Weight 386.46
Cross Link
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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