CFam Chemical Families Database
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You are searching for "CFAMM00043778" 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 CFAMM00043778
Family CFFAD249 Beta-1 adrenergic receptor Ligand Metoprolol Family
Superfamily CFSAD220 adrenergic receptor ligand Esmolol Metoprolol Superfamily
Class CFCAD149 Class 149
External ID ZINC04025043 External Source ZINC
PubChem CID 7075605 Functional Category Natural Product
Molecule Name [(1R)-1-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]ethyl]-[(2S)-2-hydroxy-3-phenoxypropyl]azanium
IUPAC Name [(1R)-1-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]ethyl]-[(2S)-2-hydroxy-3-phenoxypropyl]azanium
Synonyms AC1OE9PA;[(1R)-1-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]ethyl]-[(2S)-2-hydroxy-3-phenoxypropyl]azanium
InChi InChI=1S/C19H23NO4/c1-14(19-13-23-17-9-5-6-10-18(17)24-19)20-11-15(21)12-22-16-7-3-2-4-8-16/h2-10,14-15,19-21H,11-13H2,1H3/p+1/t14-,15+,19+/m1/s1
InChiKey CZLWUFZQTCVKEE-VCBZYWHSSA-O
Formula C19H24NO4+ Molecular Weight 330.40
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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