CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00525449" 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 CFAMM00525449
Family CFFBM45144 3-oxo-5-alpha-steroid 4-dehydrogenase 1 inhibitor AGN-PC-04F7MQ family
Superfamily CFSID1992 Cholesteryl ester transfer protein Inhibitor Tetrahydroquinoline A Superfamily
Class CFCID134 Class 1484
External ID 18942646 External Source PubChem
PubChem CID 18942646 Functional Category Patent Compound
Molecule Name AGN-PC-022XKR
IUPAC Name [4-[1-(4-acetyloxyphenyl)-1-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethyl]phenyl] acetate
Synonyms SureCN8718893;[4-[1-(4-acetyloxyphenyl)-1-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]ethyl]phenyl] acetate
InChi InChI=1S/C38H35NO4/c1-26-6-16-33(17-7-26)39(34-18-8-27(2)9-19-34)35-20-10-30(11-21-35)38(5,31-12-22-36(23-13-31)42-28(3)40)32-14-24-37(25-15-32)43-29(4)41/h6-25H,1-5H3
InChiKey CYEUOZDNVRJVHH-UHFFFAOYSA-N
Formula C38H35NO4 Molecular Weight 569.69
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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