CFam Chemical Families Database
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You are searching for "CFAMM00109853" in compound.

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CFAM Mol ID CFAMM00109853
Family CFFAD880 Aldehyde oxidase Inhibitor Isovanillin Family
Superfamily CFSAD739 Aldehyde oxidase Inhibitor Isovanillin Superfamily
Class CFCAD663 Class 663
External ID HMDB12308 External Source HMDB
PubChem CID 1183 Functional Category Human Metabolite
Molecule Name Vanillin
IUPAC Name 4-hydroxy-3-methoxybenzaldehyde
Synonyms 2-Methoxy-4-formylphenol;3-Methoxy-4-hydroxybenzaldehyde;3-Methoxy-4-hydroxybenzaldehyde (vanillin);4-Formyl-2-methoxyphenol;4-hydroxy 3-methoxybenzaldehyde;4-Hydroxy-3-methoxy-benzaldehyde;4-Hydroxy-3-methoxy-Benzaldehyde-5-chlorovanillin;4-Hydroxy-3-methoxybenzaldehyde;4-Hydroxy-3-methoxybenzaldehyde (ACD/Name 4.0);4-Hydroxy-3-methoxybenzaldehyde (vanillin);4-Hydroxy-5-methoxybenzaldehyde;4-Hydroxy-m-anisaldehyde;Lioxin;M-Methoxy-p-hydroxybenzaldehyde;Methyl-Protocatechualdehyde;Methylprotcatechuic aldehyde;Methylprotocatechuic aldehyde;Oleo-Resins vanilla;Oleo-Resins vanilla-bean;Oleoresin vanilla;P-Hydroxy-m-methoxybenzaldehyde;P-Vanillin;Propenylguaethol;Protocatechualdehyde 3-methyl ether;trans-2-Ethoxy-5-(1-propenyl)phenol;Vanilin;Vaniline;Vanilla;Vanilla oleoresin;Vanilla oleoresin (vanilla SPP);Vanillaldehyde;Vanillic aldehyde;Vanillin (3-methoxy-4-hydroxy- benzaldehyde);Vanillin (natural);Vanillin (NF);Vanillin sodium salt;Vanillin [usan];Vanilline;Zimco
InChi InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3
InChiKey MWOOGOJBHIARFG-UHFFFAOYSA-N
Formula C8H8O3 Molecular Weight 152.15
Cross Link CHEMBL13883
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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