CFam Chemical Families Database
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You are searching for "CFAMM00230684" in compound.

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CFAM Mol ID CFAMM00230684
Family CFFID1180 Thromboxane-A synthase Inhibitor CGS-22652 Family
Superfamily CFSID955 Thromboxane-A synthase Inhibitor CGS-22652 Superfamily
Class CFCCD315 Class 1128
External ID DNC003758 External Source TTD
PubChem CID 131717 Functional Category Investigative Drug
Molecule Name CGS-22652
IUPAC Name 8-[(4-chlorophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoic acid
Synonyms CGS-22652;(+-)-gamma-(4-(((4-Chlorophenyl)sulfonyl)amino)butyl)-3-pyridineheptanoic acid;(R,S)-8-((4-Chlorophenylsulfonyl)amino)-4-(3-(3-pyridinyl)propyl)octanoic acid;3-Pyridineheptanoic acid, gamma-(4-(((4-chlorophenyl)sulfonyl)amino)butyl)-, (+-)-;134235-78-2;8-CSAPOA;AC1L2ZNZ;SureCN9710116;C22H29ClN2O4S;CHEMBL65414
InChi InChI=1S/C22H29ClN2O4S/c23-20-10-12-21(13-11-20)30(28,29)25-16-2-1-5-18(9-14-22(26)27)6-3-7-19-8-4-15-24-17-19/h4,8,10-13,15,17-18,25H,1-3,5-7,9,14,16H2,(H,26,27)
InChiKey ISMHAZMNDUAHLK-UHFFFAOYSA-N
Formula C22H29ClN2O4S Molecular Weight 452.99
Cross Link CHEMBL65414
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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