CFam Chemical Families Database
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You are searching for "CFAMM00112561" 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 CFAMM00112561
Family CFFAD911 Noradrenergic re-uptake Inhibitor Desvenalfaxine Succinate Family
Superfamily CFSAD767 Noradrenergic re-uptake Inhibitor Desvenalfaxine Succinate Superfamily
Class CFCAD684 Class 684
External ID CHEMBL100913 External Source CHEMBL
PubChem CID 19065046 Functional Category Bioactive
Molecule Name SureCN8777872
IUPAC Name 3-[4-(4-hydroxyphenyl)phenyl]-1-azabicyclo[2.2.2]octan-3-ol
Synonyms AGN-PC-0267G7;CHEBI:264965;1-Azabicyclo[2.2.2]octan-3-ol, 3-(4'-hydroxy[1,1'-biphenyl]-4-yl)-
InChi InChI=1S/C19H21NO2/c21-18-7-3-15(4-8-18)14-1-5-16(6-2-14)19(22)13-20-11-9-17(19)10-12-20/h1-8,17,21-22H,9-13H2
InChiKey DMMXQRSFLVFTNK-UHFFFAOYSA-N
Formula C19H21NO2 Molecular Weight 295.38
Cross Link CHEMBL100913
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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