CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00111995" 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 CFAMM00111995
Family CFFAD894 5-hydroxytryptamine receptor 2A Ligand Sarpogrelate Family
Superfamily CFSAD752 5-hydroxytryptamine receptor 2A Ligand Sarpogrelate Superfamily
Class CFCAD51 Class 51
External ID 53678352 External Source PubChem
PubChem CID 53678352 Functional Category Patent Compound
Molecule Name AGN-PC-09XD4W
IUPAC Name 1,3-bis(2-nonylphenoxy)propan-2-ol
Synonyms SureCN6843990;2-Propanol, 1,3-bis(nonylphenoxy)-
InChi InChI=1S/C33H52O3/c1-3-5-7-9-11-13-15-21-29-23-17-19-25-32(29)35-27-31(34)28-36-33-26-20-18-24-30(33)22-16-14-12-10-8-6-4-2/h17-20,23-26,31,34H,3-16,21-22,27-28H2,1-2H3
InChiKey BEUPOTJNFFCYIC-UHFFFAOYSA-N
Formula C33H52O3 Molecular Weight 496.76
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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