CFam Chemical Families Database
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You are searching for "CFAMM00109373" in compound.

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CFAM Mol ID CFAMM00109373
Family CFFAD880 Aldehyde oxidase Inhibitor Isovanillin Family
Superfamily CFSAD739 Aldehyde oxidase Inhibitor Isovanillin Superfamily
Class CFCAD663 Class 663
External ID ZINC00057165 External Source ZINC
PubChem CID 15956 Functional Category Natural Product
Molecule Name Methyl 3,4,5-trimethoxybenzoate
IUPAC Name methyl 3,4,5-trimethoxybenzoate
Synonyms 1916-07-0;Methyl tri-O-methylgallate;BENZOIC ACID, 3,4,5-TRIMETHOXY-, METHYL ESTER;Trimethylgallic acid methyl ester;3,4,5-Trimethoxybenzoic acid methyl ester;3,4,5-Trimethoxybenzoic acid, methyl ester;Methyl 3,4,5-trimethoxy benzoate;EINECS 217-629-3;NSC 16955;AG-E-39950
InChi InChI=1S/C11H14O5/c1-13-8-5-7(11(12)16-4)6-9(14-2)10(8)15-3/h5-6H,1-4H3
InChiKey KACHFMOHOPLTNX-UHFFFAOYSA-N
Formula C11H14O5 Molecular Weight 226.23
Cross Link CHEMBL1651039
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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