CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00016602" 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 CFAMM00016602
Family CFFAD80 Alpha-2 adrenergic receptor Ligand Yohimbine Family
Superfamily CFSAD78 Alpha-2 adrenergic receptor Ligand Yohimbine Superfamily
Class CFCAD78 Class 78
External ID DNC009968 External Source TTD
PubChem CID 6169 Functional Category Investigative Drug
Molecule Name Yohimbine Hydrochloride
IUPAC Name methyl (1S,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;hydrochloride
Synonyms Antagonil;Yohimbe;Aphrodine hydrochloride;Yohimbine HCl;Yohimbine monohydrochloride;65-19-0;UNII-NB2E1YP49F;Yohimbin hydrochloride [USP];65-19-0(hcl);EINECS 200-600-4
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+;/m0./s1
InChiKey PIPZGJSEDRMUAW-VJDCAHTMSA-N
Formula C21H27ClN2O3 Molecular Weight 390.90
Cross Link CHEMBL537669
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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