CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00060465" 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 CFAMM00060465
Family CFFAD428 Angiotensin-converting enzyme Inhibitor Moexipril Family
Superfamily CFSAD371 Angiotensin-converting enzyme Inhibitor Moexipril Superfamily
Class CFCAD92 Class 92
External ID ZINC12902033 External Source ZINC
PubChem CID 17572175 Functional Category Natural Product
Molecule Name (S)-4-(7,8-dimethoxy-1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)-N-(2-hydroxyethyl)butanamide
IUPAC Name 4-[(10aS)-7,8-dimethoxy-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-(2-hydroxyethyl)butanamide
Synonyms MolPort-005-910-594;ZINC12902033;MCULE-5057086246
InChi InChI=1S/C19H25N3O6/c1-27-15-9-12-8-14-18(25)21(6-3-4-17(24)20-5-7-23)19(26)22(14)11-13(12)10-16(15)28-2/h9-10,14,23H,3-8,11H2,1-2H3,(H,20,24)/t14-/m0/s1
InChiKey BQIUWHXYFIWBAU-AWEZNQCLSA-N
Formula C19H25N3O6 Molecular Weight 391.42
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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