GOLM METABOLOME DATABASE

Details of Vanillin

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Role Metabolite
MPIMP IDM001432
stereoisomer 
isotopomerambient
formulaC8H8O3
molecular mass152.148
monoisotopic mass152.04735
InChIInChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3
InChIKeyMWOOGOJBHIARFG-UHFFFAOYSA-N
class 
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%277c452c9c-4ee3-44e5-9c73-ce0e8b140775%27)

Synonyms of Vanillin

propertyvalue
CAS121-33-5
ChEBI IDChEBI:18346
ChEBI ontologyhas role anticonvulsant
ChEBI ontologyhas role antioxidant
ChEBI ontologyhas role flavouring agent
ChEBI ontologyhas role secondary metabolite
ChEBI ontologyis a benzaldehydes
ChEBI ontologyis a phenols
ChemSpider ID13860434
CHLAMYCYC-ID4-HYDROXYPHENYLACETATE
26 synonym(s)

Derivatives of Vanillin

Reference substances of Vanillin

reference substancesuppliersupplier codelot
VanillinSigmaV2375 
VanillinSigma947501078560 11005242
2 reference substance(s)

Isotopomers and stereoisomers of Vanillin

Quantitative Vanillin Profile Data

Each graph visualises metabolite concentrations across a single metabolite profiling experiment. Each box plot represents relative (normalised) metabolite concentrations for single replica groups in the specific metabolite profiling experiment.
NameOrganismFactorHeatmapBox plotVarianceAnova F score
no metabolite profile(s) found.

Qualitative Vanillin Profile Data

species
no qualitative metabolite profile data available!
compound timestamp information
deposited at 8/29/2006 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 8/7/2013 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Kopka J., Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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