CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00115789" 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 CFAMM00115789
Family CFFAD982 Hidrosmin family
Superfamily CFSAD705 D-alanyl-D-alanine carboxypeptidase inhibitor B-Lactams Superfamily
Class CFCAD637 Class 637
External ID 19888084 External Source PubChem
PubChem CID 19888084 Functional Category Patent Compound
Molecule Name AGN-PC-02LI5N
IUPAC Name ethyl 3-hydroxy-3-[3-methoxy-4-(oxan-2-yloxy)phenyl]-2-phenylpropanoate
Synonyms SureCN9677347;ethyl 3-hydroxy-3-[3-methoxy-4-(oxan-2-yloxy)phenyl]-2-phenylpropanoate
InChi InChI=1S/C23H28O6/c1-3-27-23(25)21(16-9-5-4-6-10-16)22(24)17-12-13-18(19(15-17)26-2)29-20-11-7-8-14-28-20/h4-6,9-10,12-13,15,20-22,24H,3,7-8,11,14H2,1-2H3
InChiKey GVOKTVTZFICFDY-UHFFFAOYSA-N
Formula C23H28O6 Molecular Weight 400.46
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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