CFam Chemical Families Database
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You are searching for "CFAMM00046147" in compound.

Total 1 results found.

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 CFAMM00046147
Family CFFAD280 Muscarinic acetylcholine receptor Ligand Flutropium Bromide Family
Superfamily CFSAD247 Muscarinic acetylcholine receptor Ligand Flutropium Bromide Superfamily
Class CFCAD237 Class 237
External ID CHEMBL192485 External Source CHEMBL
PubChem CID 9998202 Functional Category Bioactive
Molecule Name SureCN509220
IUPAC Name 4-(3-azabicyclo[3.1.0]hexan-3-yl)but-2-ynyl 2-cyclopentyl-2-hydroxy-2-phenylacetate
Synonyms AGN-PC-00E18X;CHEBI:421998;L022724;4-[(1R,5S)-3-azabicyclo[3.1.0]hexan-3-yl]but-2-ynyl (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetate
InChi InChI=1S/C22H27NO3/c24-21(26-13-7-6-12-23-15-17-14-18(17)16-23)22(25,20-10-4-5-11-20)19-8-2-1-3-9-19/h1-3,8-9,17-18,20,25H,4-5,10-16H2
InChiKey PRTRYQFFLDMTMW-UHFFFAOYSA-N
Formula C22H27NO3 Molecular Weight 353.45
Cross Link CHEMBL192485
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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