CFam Chemical Families Database
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You are searching for "CFAMM00109441" 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 CFAMM00109441
Family CFFAD880 Aldehyde oxidase Inhibitor Isovanillin Family
Superfamily CFSAD739 Aldehyde oxidase Inhibitor Isovanillin Superfamily
Class CFCAD663 Class 663
External ID HMDB00484 External Source HMDB
PubChem CID 8468 Functional Category Human Metabolite
Molecule Name Vanillic acid
IUPAC Name 4-hydroxy-3-methoxybenzoic acid
Synonyms 3-Methoxy-4-hydroxybenzoate;3-Methoxy-4-hydroxybenzoic acid;4-Hydroxy-3-methoxy-Benzoate;4-Hydroxy-3-methoxy-Benzoic acid;4-Hydroxy-3-methoxybenzoate;4-Hydroxy-3-methoxybenzoic acid;4-Hydroxy-m-Anisate;4-Hydroxy-m-Anisic acid;Acide vanillique;p-Vanillate;p-Vanillic acid;Protocatechuic acid 3-methyl ester;Vanillate;Vanillic acid
InChi InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)
InChiKey WKOLLVMJNQIZCI-UHFFFAOYSA-N
Formula C8H8O4 Molecular Weight 168.15
Cross Link CHEMBL120568
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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