CFam Chemical Families Database
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You are searching for "CFAMM00016614" in compound.

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CFAM Mol ID CFAMM00016614
Family CFFAD80 Alpha-2 adrenergic receptor Ligand Yohimbine Family
Superfamily CFSAD78 Alpha-2 adrenergic receptor Ligand Yohimbine Superfamily
Class CFCAD78 Class 78
External ID CHEMBL1257131 External Source CHEMBL
PubChem CID 197067 Functional Category Bioactive
Molecule Name Rauwolscine hydrochloride
IUPAC Name methyl (1S,15S,18S,19S,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;hydrochloride
Synonyms alpha-Yohimbine hydrochloride;Rauwolscine HCl;Fauwolscine, hydrochloride;alpha-Yohimbin hydrochloride;EINECS 228-279-6;NSC 407307;6211-32-1;20-alpha-Yohimban-16-beta-carboxylic acid, 17-alpha-hydroxy-, methyl ester, hydrochloride;Methyl (16beta,17alpha,20alpha)-17-hydroxyyohimban-16-carboxylate hydrochloride;SMR000718802
InChi InChI=1S/C21H26N2O3.ClH/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24;/h2-5,12,15,17-19,22,24H,6-11H2,1H3;1H/t12-,15+,17+,18+,19+;/m1./s1
InChiKey PIPZGJSEDRMUAW-ZKKXXTDSSA-N
Formula C21H27ClN2O3 Molecular Weight 390.90
Cross Link CHEMBL1257131
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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