CFam Chemical Families Database
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You are searching for "CFAMM00369542" 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 CFAMM00369542
Family CFFBM6045 Type-2 angiotensin II receptor ligand SureCN244657 family
Superfamily CFSBM1788 Prelamin-A/C and Cellular tumor antigen p53 Binder Superfamily 4
Class CFCAD92 Class 92
External ID CHEMBL156129 External Source CHEMBL
PubChem CID 22402420 Functional Category Bioactive
Molecule Name AGN-PC-03OSB8
IUPAC Name 2-(2,2-diphenylacetyl)-6-methoxy-5-(2-phenylethoxy)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Synonyms SureCN3517157;CHEBI:361162;2-(2,2-diphenylacetyl)-6-methoxy-5-(2-phenylethoxy)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
InChi InChI=1S/C33H31NO5/c1-38-29-18-17-26-22-34(32(35)30(24-13-7-3-8-14-24)25-15-9-4-10-16-25)28(33(36)37)21-27(26)31(29)39-20-19-23-11-5-2-6-12-23/h2-18,28,30H,19-22H2,1H3,(H,36,37)
InChiKey FHPFOZINLKCVGP-UHFFFAOYSA-N
Formula C33H31NO5 Molecular Weight 521.60
Cross Link CHEMBL156129
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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