CFam Chemical Families Database
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You are searching for "CFAMM00060496" 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 CFAMM00060496
Family CFFAD428 Angiotensin-converting enzyme Inhibitor Moexipril Family
Superfamily CFSAD371 Angiotensin-converting enzyme Inhibitor Moexipril Superfamily
Class CFCAD92 Class 92
External ID CHEMBL521649 External Source CHEMBL
PubChem CID 11734173 Functional Category Bioactive
Molecule Name SureCN246714
IUPAC Name N-butyl-2-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenylacetamide
Synonyms AGN-PC-00F2MB;CHEBI:554994;N-butyl-2-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-phenylacetamide
InChi InChI=1S/C32H40N2O5/c1-6-7-16-33-32(35)31(23-11-9-8-10-12-23)34-17-15-24-20-29(38-4)30(39-5)21-25(24)26(34)18-22-13-14-27(36-2)28(19-22)37-3/h8-14,19-21,26,31H,6-7,15-18H2,1-5H3,(H,33,35)
InChiKey IHCFTGHARRXKNR-UHFFFAOYSA-N
Formula C32H40N2O5 Molecular Weight 532.67
Cross Link CHEMBL521649
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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