CFam Chemical Families Database
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You are searching for "CFAMM00061084" in compound.

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CFAM Mol ID CFAMM00061084
Family CFFAD432 Beta adrenergic receptor Ligand Dipivefrin Family
Superfamily CFSAD375 Beta adrenergic receptor Ligand Dipivefrin Superfamily
Class CFCAD332 Class 332
External ID DNAP001566 External Source TTD
PubChem CID 156320 Functional Category Approved Drug
Molecule Name Ibopamine hci
IUPAC Name [4-[2-(methylamino)ethyl]-2-(2-methylpropanoyloxy)phenyl] 2-methylpropanoate;hydrochloride
Synonyms Ibopamine hydrochloride;Scandine;Inopamil hydrochloride;EINECS 278-056-2;75011-65-3;SB 7505;N-Methyldopamine,O,O'-diisobutyroylester.HCl;N-Methyl-3,4-O-diisobutyryldopamine hydrochloride;4-(2-(Methylamino)ethyl)-1,2-phenylene isobutyrate hydrochloride;4-(2-(Methylaminoethyl))-o-phenylene diisobutyrate hydrochloride
InChi InChI=1S/C17H25NO4.ClH/c1-11(2)16(19)21-14-7-6-13(8-9-18-5)10-15(14)22-17(20)12(3)4;/h6-7,10-12,18H,8-9H2,1-5H3;1H
InChiKey ALIXRWKJZYLBJI-UHFFFAOYSA-N
Formula C17H26ClNO4 Molecular Weight 343.85
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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