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Details of Benzen-1,3-Dicarboxylic acid

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Role Metabolite
MPIMP IDM001517
stereoisomer 
isotopomerambient
formulaC8H6O4
molecular mass166.131
monoisotopic mass166.02661
InChIInChI=1S/C8H6O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)(H,11,12)
InChIKeyQQVIHTHCMHWDBS-UHFFFAOYSA-N
class 
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%2737010a30-0dbc-4f6f-a45e-e96da70e2986%27)

Synonyms of Benzen-1,3-Dicarboxylic acid

propertyvalue
CAS121-91-5
ChEBI IDCHEBI:30802
ChEBI ontologyis a benzenedicarboxylic acid
ChEBI ontologyis conjugate acid of isophthalate(1-)
ChemSpider ID8182
synonymBenzen-1,3-Dicarboxylic acid
synonymbenzene-1,3-dicarboxylic acid
synonymIPA
synonymisophthalic acid
synonymm-benzenedicarboxylic acid
11 synonym(s)

Derivatives of Benzen-1,3-Dicarboxylic acid

Reference substances of Benzen-1,3-Dicarboxylic acid

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No Reference substances found!

Isotopomers and stereoisomers of Benzen-1,3-Dicarboxylic acid

Quantitative Benzen-1,3-Dicarboxylic 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 Benzen-1,3-Dicarboxylic 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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