CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00531139" 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 CFAMM00531139
Family CFFHM47 Carboxylic Acids and Derivatives Metabolite Citramalic acid Family
Superfamily CFSHM34 Carboxylic Acids Metabolite Citramalic acid and Sugar Acids Metabolite A,b-Dihydroxyisobutyric acid Superfamily
Class CFCHM22 Class 7107
External ID 54405733 External Source PubChem
PubChem CID 54405733 Functional Category Patent Compound
Molecule Name AGN-PC-0A91CE
IUPAC Name 3-hydroxy-4-methoxy-3-methyl-4-oxobutanoic acid
Synonyms 3-hydroxy-4-methoxy-3-methyl-4-oxobutanoic acid
InChi InChI=1S/C6H10O5/c1-6(10,3-4(7)8)5(9)11-2/h10H,3H2,1-2H3,(H,7,8)
InChiKey VQNKVZAIEXAESZ-UHFFFAOYSA-N
Formula C6H10O5 Molecular Weight 162.14
Cross Link
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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