CFam Chemical Families Database
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You are searching for "CFAMM00126435" in compound.

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CFAM Mol ID CFAMM00126435
Family CFFAD1105 Citric Acid family
Superfamily CFSAD928 Citric Acid Superfamily
Class CFCAD805 Class 805
External ID CHEMBL1165544 External Source CHEMBL
PubChem CID 46703038 Functional Category Bioactive
Molecule Name (6E)-3-(diethylamino)-6-[(6-pyridin-3-yl-1,2,3,4-tetrahydropyridin-5-yl)methylidene]cyclohexa-2,4-dien-1-one
IUPAC Name (6E)-3-(diethylamino)-6-[(6-pyridin-3-yl-1,2,3,4-tetrahydropyridin-5-yl)methylidene]cyclohexa-2,4-dien-1-one
Synonyms CHEBI:746968
InChi InChI=1S/C21H25N3O/c1-3-24(4-2)19-10-9-16(20(25)14-19)13-17-7-6-12-23-21(17)18-8-5-11-22-15-18/h5,8-11,13-15,25H,3-4,6-7,12H2,1-2H3/b17-13+
InChiKey LTIOVKFOJFTNGQ-GHRIWEEISA-N
Formula C21H25N3O Molecular Weight 335.44
Cross Link CHEMBL1165544
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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