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Details of 4-Methylbenzoic acid

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Role Metabolite
MPIMP IDM001454
stereoisomer 
isotopomerambient
formulaC8H8O2
molecular mass136.148
monoisotopic mass136.05243
InChIInChI=1S/C8H8O2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3,(H,9,10)
InChIKeyLPNBBFKOUUSUDB-UHFFFAOYSA-N
class 
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27be99560f-8fb5-40c8-8216-a529fd051de5%27)

Synonyms of 4-Methylbenzoic acid

propertyvalue
CAS99-94-5
ChEBI IDCHEBI:36635
ChEBI ontologyis a methylbenzoic acid
ChEBI ontologyis conjugate acid of p-toluate
ChemSpider ID7190
synonym4-methylbenzoic acid
synonym4-Toluic acid
synonymCrithminic acid
synonympara-Toluic acid
synonymp-Carboxytoluene
14 synonym(s)

Derivatives of 4-Methylbenzoic acid

Reference substances of 4-Methylbenzoic acid

reference substancesuppliersupplier codelot
No Reference substances found!

Isotopomers and stereoisomers of 4-Methylbenzoic acid

Quantitative 4-Methylbenzoic acid 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 4-Methylbenzoic acid Profile Data

species
no qualitative metabolite profile data available!
compound timestamp information
deposited at 9/24/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 10/1/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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