CFam Chemical Families Database
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You are searching for "CFAMM00121812" 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 CFAMM00121812
Family CFFAD1063 taste receptor Ligand Cynarin Family
Superfamily CFSAD893 taste receptor Ligand Cynarin Superfamily
Class CFCAD780 Class 780
External ID 54249766 External Source PubChem
PubChem CID 54249766 Functional Category Patent Compound
Molecule Name AGN-PC-0A4TU7
IUPAC Name 6-benzoyloxyhexyl 4-hydroxybenzoate
Synonyms SureCN5155759;6-benzoyloxyhexyl 4-hydroxybenzoate
InChi InChI=1S/C20H22O5/c21-18-12-10-17(11-13-18)20(23)25-15-7-2-1-6-14-24-19(22)16-8-4-3-5-9-16/h3-5,8-13,21H,1-2,6-7,14-15H2
InChiKey QVXSUCQXZVUHHK-UHFFFAOYSA-N
Formula C20H22O5 Molecular Weight 342.39
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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