CFam Chemical Families Database
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You are searching for "CFAMM00453875" 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 CFAMM00453875
Family CFFBM19965 3-oxo-5-alpha-steroid 4-dehydrogenase 1 inhibitor AGN-PC-007ZSJ family
Superfamily CFSBM7760 Ferritin light chain and Cellular tumor antigen p53 Binder Superfamily 11
Class CFCID91 Class 1441
External ID CHEMBL116432 External Source CHEMBL
PubChem CID 11363043 Functional Category Bioactive
Molecule Name AGN-PC-007LH9
IUPAC Name 8-[[2,5-bis(trifluoromethyl)phenyl]methoxy]-4-methyl-1,2,5,6-tetrahydrobenzo[f]quinolizin-3-one
Synonyms CHEBI:295337;8-[[2,5-bis(trifluoromethyl)phenyl]methoxy]-4-methyl-1,2,5,6-tetrahydrobenzo[f]quinolizin-3-one
InChi InChI=1S/C23H19F6NO2/c1-13-19-6-2-14-11-17(4-7-20(14)30(19)9-8-21(13)31)32-12-15-10-16(22(24,25)26)3-5-18(15)23(27,28)29/h3-5,7,10-11H,2,6,8-9,12H2,1H3
InChiKey PUUJLIUTVQQMAT-UHFFFAOYSA-N
Formula C23H19F6NO2 Molecular Weight 455.39
Cross Link CHEMBL116432
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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