CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00538196" 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 CFAMM00538196
Family CFFHM924 Fatty Acid Esters Metabolite Methyl 5-methylhexanoate Family
Superfamily CFSHM541 Fatty Acid Esters Metabolite Methyl 5-methylhexanoate Superfamily
Class CFCHM270 Class 7355
External ID 12885826 External Source PubChem
PubChem CID 12885826 Functional Category Patent Compound
Molecule Name AGN-PC-00JXS1
IUPAC Name dimethyl 2-(3-methylbutyl)propanedioate
Synonyms Propanedioic acid, (3-methylbutyl)-, dimethyl ester
InChi InChI=1S/C10H18O4/c1-7(2)5-6-8(9(11)13-3)10(12)14-4/h7-8H,5-6H2,1-4H3
Formula C10H18O4 Molecular Weight 202.25
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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).

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