CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00043787" 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 CFAMM00043787
Family CFFAD249 Beta-1 adrenergic receptor Ligand Metoprolol Family
Superfamily CFSAD220 adrenergic receptor ligand Esmolol Metoprolol Superfamily
Class CFCAD149 Class 149
External ID HMDB41935 External Source HMDB
PubChem CID 71213 Functional Category Human Metabolite
Molecule Name Moprolol
IUPAC Name [2-hydroxy-3-(2-methoxyphenoxy)propyl](propan-2-yl)amine
Synonyms (+)-1-(O-(Allyloxy)phenoxy)-3-(isopropylamino)propan-2-ol;(+-)-oxprenolol;(1)-1-(O-(Allyloxy)phenoxy)-3-(isopropylamino)propan-2-ol;1-(Isopropylamino)-2-hydroxy-3-(O-(allyloxy)phenoxy)propane;1-(O-(Allyloxy)phenoxy)-3-(isopropylamino)-2-propanol;1-[2-(Allyloxy)phenoxy]-3-(isopropylamino)-2-propanol;DL-oxprenolol;Osprenololo [dcit];Oxprenololum [inn-latin]
InChi InChI=1S/C13H21NO3/c1-10(2)14-8-11(15)9-17-13-7-5-4-6-12(13)16-3/h4-7,10-11,14-15H,8-9H2,1-3H3
InChiKey LFTFGCDECFPSQD-UHFFFAOYSA-N
Formula C13H21NO3 Molecular Weight 239.31
Cross Link CHEMBL156901
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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