CFam Chemical Families Database
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You are searching for "CFAMM00152516" in compound.

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CFAM Mol ID CFAMM00152516
Family CFFCD338 Glucokinase Inhibitor R7201 Family
Superfamily CFSCD312 Glucokinase Inhibitor R7201 Superfamily
Class CFCCD229 Class 1042
External ID CHEMBL2172382 External Source CHEMBL
PubChem CID 57556431 Functional Category Bioactive
Molecule Name 4-[[(3S,3'R,4'S,5'S,6'R)-3',4',5'-trihydroxy-6'-(hydroxymethyl)spiro[1H-2-benzofuran-3,2'-oxane]-5-yl]methyl]benzonitrile
IUPAC Name 4-[[(3S,3'R,4'S,5'S,6'R)-3',4',5'-trihydroxy-6'-(hydroxymethyl)spiro[1H-2-benzofuran-3,2'-oxane]-5-yl]methyl]benzonitrile
Synonyms SureCN13201803
InChi InChI=1S/C21H21NO6/c22-9-13-3-1-12(2-4-13)7-14-5-6-15-11-27-21(16(15)8-14)20(26)19(25)18(24)17(10-23)28-21/h1-6,8,17-20,23-26H,7,10-11H2/t17-,18-,19+,20-,21+/m1/s1
InChiKey SXDBPOMGXXFOGD-ADAARDCZSA-N
Formula C21H21NO6 Molecular Weight 383.39
Cross Link CHEMBL2172382
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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