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Details of benzylsuccinic acid

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Role Metabolite
MPIMP IDM001523
stereoisomer 
isotopomerambient
formulaC11H12O4
molecular mass208.211
monoisotopic mass208.07356
InChIInChI=1S/C11H12O4/c12-10(13)7-9(11(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)(H,14,15)
InChIKeyGTOFKXZQQDSVFH-UHFFFAOYSA-N
class 
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27c31ab1b8-b425-4daf-814c-c8e7a38e40e1%27)

Synonyms of benzylsuccinic acid

propertyvalue
CAS884-33-3
ChEBI IDCHEBI:16054
ChEBI ontologyhas functional parent succinic acid
ChEBI ontologyis a dicarboxylic acid
ChEBI ontologyis conjugate acid of (R)-2-benzylsuccinate
ChEBI ontologyis conjugate acid of 2-benzylsuccinate(2-)
ChemSpider ID3724
synonym(phenylmethyl)butanedioic acid
synonym2-benzylbutanedioic acid
synonym2-benzylsuccinic acid
15 synonym(s)

Derivatives of benzylsuccinic acid

Reference substances of benzylsuccinic acid

reference substancesuppliersupplier codelot
No Reference substances found!

Isotopomers and stereoisomers of benzylsuccinic acid

Quantitative benzylsuccinic 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 benzylsuccinic 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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