CFam Chemical Families Database
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You are searching for "CFAMM00374627" in compound.

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CFAM Mol ID CFAMM00374627
Family CFFBM6738 Thromboxane-A synthase and Prostacyclin synthase inhibitor (Z)-6-[2-[1-(2-cyano-4-fluorophenyl)-2-methylpropan-2-yl]-4-pyridin-3-yl-1,3-dioxan-5-yl]hex-4-enoic acid family
Superfamily CFSBM3873 Thromboxane-A synthase and Prostacyclin synthase inhibitor (Z)-6-[2-[1-(2-cyano-4-fluorophenyl)-2-methylpropan-2-yl]-4-pyridin-3-yl-1,3-dioxan-5-yl]hex-4-enoic acid Superfamily
Class CFCBM1415 Class 4465
External ID CHEMBL161104 External Source CHEMBL
PubChem CID 44374700 Functional Category Bioactive
Molecule Name (Z)-6-[2-(2-cyanophenyl)-4-pyridin-3-yl-1,3-dioxan-5-yl]hex-4-enoic acid
IUPAC Name (Z)-6-[2-(2-cyanophenyl)-4-pyridin-3-yl-1,3-dioxan-5-yl]hex-4-enoic acid
Synonyms CHEBI:367995
InChi InChI=1S/C22H22N2O4/c23-13-16-7-4-5-10-19(16)22-27-15-18(8-2-1-3-11-20(25)26)21(28-22)17-9-6-12-24-14-17/h1-2,4-7,9-10,12,14,18,21-22H,3,8,11,15H2,(H,25,26)/b2-1-
InChiKey SMPANMCXFZXSLU-UPHRSURJSA-N
Formula C22H22N2O4 Molecular Weight 378.42
Cross Link CHEMBL161104
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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