CFam Chemical Families Database
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You are searching for "CFAMM00449083" in compound.

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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 CFAMM00449083
Family CFFBM18775 NAD(P)H dehydrogenase [quinone] 1 inhibitor AGN-PC-0AKS1I family
Superfamily CFSBM7404 NAD(P)H dehydrogenase [quinone] 1 inhibitor AGN-PC-0AKS1I Superfamily
Class CFCBM439 Class 3489
External ID CHEMBL572166 External Source CHEMBL
PubChem CID 54736426 Functional Category Bioactive
Molecule Name AGN-PC-0AKS1I
IUPAC Name 6-chloro-3-[(6-chloro-4-hydroxy-2-oxochromen-3-yl)methyl]-4-hydroxychromen-2-one
Synonyms symmetric dicoumarol analogue, 8;6-chloro-3-[(6-chloro-4-hydroxy-2-oxochromen-3-yl)methyl]-4-hydroxychromen-2-one
InChi InChI=1S/C19H10Cl2O6/c20-8-1-3-14-10(5-8)16(22)12(18(24)26-14)7-13-17(23)11-6-9(21)2-4-15(11)27-19(13)25/h1-6,22-23H,7H2
InChiKey PLTAUBVYMSAINB-UHFFFAOYSA-N
Formula C19H10Cl2O6 Molecular Weight 405.19
Cross Link CHEMBL572166
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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