CFam Chemical Families Database
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You are searching for "CFAMM00459220" 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 CFAMM00459220
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 CHEMBL343811 External Source CHEMBL
PubChem CID 54728724 Functional Category Bioactive
Molecule Name AGN-PC-0AKNGD
IUPAC Name 11-benzyl-4-hydroxy-3-(1-phenylpropyl)-6,7,8,9,10,11-hexahydro-5H-cyclonona[b]pyran-2-one
Synonyms CHEBI:330626;11-benzyl-4-hydroxy-3-(1-phenylpropyl)-6,7,8,9,10,11-hexahydro-5H-cyclonona[b]pyran-2-one
InChi InChI=1S/C28H32O3/c1-2-23(21-15-10-6-11-16-21)25-26(29)24-18-12-4-3-9-17-22(27(24)31-28(25)30)19-20-13-7-5-8-14-20/h5-8,10-11,13-16,22-23,29H,2-4,9,12,17-19H2,1H3
InChiKey QEYQUQCTTUQQLK-UHFFFAOYSA-N
Formula C28H32O3 Molecular Weight 416.55
Cross Link CHEMBL343811
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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