CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00526077" 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 CFAMM00526077
Family CFFBM45452 Cysteinyl leukotriene receptor 2 and Cysteinyl leukotriene receptor 1 ligand AGN-PC-000EDR family
Superfamily CFSBM6569 Cysteinyl leukotriene receptor 1 and Cysteinyl leukotriene receptor 2 Binder Superfamily 2
Class CFCBM2058 Class 5108
External ID CHEMBL286074 External Source CHEMBL
PubChem CID 14097589 Functional Category Bioactive
Molecule Name AGN-PC-000EDR
IUPAC Name 3-[2-carboxyethylsulfanyl-(5-hydroxy-2-undecoxyphenyl)methyl]sulfanylpropanoic acid
Synonyms CHEBI:147807;3-[2-carboxyethylsulfanyl-(5-hydroxy-2-undecoxyphenyl)methyl]sulfanylpropanoic acid
InChi InChI=1S/C24H38O6S2/c1-2-3-4-5-6-7-8-9-10-15-30-21-12-11-19(25)18-20(21)24(31-16-13-22(26)27)32-17-14-23(28)29/h11-12,18,24-25H,2-10,13-17H2,1H3,(H,26,27)(H,28,29)
InChiKey CEZOAWAOXBVCPM-UHFFFAOYSA-N
Formula C24H38O6S2 Molecular Weight 486.68
Cross Link CHEMBL286074
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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