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Details of cis-Aconitic acid

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Role Metabolite
MPIMP IDM000113
stereoisomerZ-
isotopomerambient
formulaC6H6O6
molecular mass174.108
monoisotopic mass174.01644
InChIInChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1-
InChIKeyGTZCVFVGUGFEME-IWQZZHSRSA-N
classAcid (Tricarboxylic)
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%2770398f21-6d08-4f6f-8e72-7ad7efc52a8b%27)

Synonyms of cis-Aconitic acid

propertyvalue
Beilstein1725829
BRENDA23413
CAS585-84-2
ChEBI IDChEBI:32805
ChEBI ontologyis a aconitic acid
ChEBI ontologyis conjugate acid of cis-aconitate(3-)
ChemSpider ID558863
MapManaconitate
PubChem CID643757
PubChem SID24890769
22 synonym(s)

Derivatives of cis-Aconitic acid

Reference substances of cis-Aconitic acid

reference substancesuppliersupplier codelot
cis-Aconitic acidSigmaA3412091K5302
cis-Aconitic acidAldrich122750 
cis-Aconitic acidSigmaA3412107H5234
cis-Aconitic acidAvocado502-79821 
cis-Aconitic acidSigmaA3412 
5 reference substance(s)

Isotopomers and stereoisomers of cis-Aconitic acid

Quantitative cis-Aconitic 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.

Qualitative cis-Aconitic acid Profile Data

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 5/21/2012 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 03/01/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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