CFam Chemical Families Database
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You are searching for "CFAMM00459213" in compound.

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CFAM Mol ID CFAMM00459213
Family CFFBM21364 Protease and Pol polyprotein inhibitor U-96988 family
Superfamily CFSBM8392 Protease and Pol polyprotein Binder Superfamily 2
Class CFCBM17 Class 3067
External ID 54724885 External Source PubChem
PubChem CID 54724885 Functional Category Patent Compound
Molecule Name AGN-PC-0ABUYU
IUPAC Name 9-but-3-enyl-3-[cyclopropyl(phenyl)methyl]-4-hydroxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyran-2-one
Synonyms SureCN7351637;9-but-3-enyl-3-[cyclopropyl(phenyl)methyl]-4-hydroxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyran-2-one
InChi InChI=1S/C24H28O3/c1-2-3-9-18-12-7-8-13-19-22(25)21(24(26)27-23(18)19)20(17-14-15-17)16-10-5-4-6-11-16/h2,4-6,10-11,17-18,20,25H,1,3,7-9,12-15H2
InChiKey IHOFVPVVBRWBEB-UHFFFAOYSA-N
Formula C24H28O3 Molecular Weight 364.48
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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