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Details
Mesaconic acid
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mol
Role
Reference Substance
name
Mesaconic acid
MPIMP ID
R000441
stereoisomer
E-
isotopomer
ambient
formula
C5H6O4
molecular mass
130.099
monoisotopic mass
130.02661
InChI
InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/b3-2+
InChIKey
HNEGQIOMVPPMNR-NSCUHMNNSA-N
supplier
Aldrich
supplier code
13,104-0
lot
S02029-343
purity
99
solubility
general
amount
10
amount unit
G
store temperature 1
RT
store temperature 2
RT
store dry
False
store under argon
False
store in dark
False
contributing author
Wrede J, Turner J, Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
date of order
date in
2000-01-01
date out
date expired
box number
19
application/atom+xml
http://gmd-dev.mpimp-golm.mpg.de/REST/gmd.svc/ReferenceSubstance(guid%27aeb7f976-126e-416c-b61d-aca427baa4a8%27)
Synonyms of
Mesaconic acid
property
value
BRENDA
20985
CAS
498-24-8
ChEBI ID
CHEBI:16600
ChEBI ontology
has functional parent fumaric acid
ChEBI ontology
has role secondary metabolite
ChEBI ontology
is a dicarboxylic acid
ChEBI ontology
is conjugate acid of mesaconate(2-)
ChemSpider ID
10289044
PubChem CID
638129
PubChem SID
92297796
20 synonym(s)
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Metabolites mapped to
Mesaconic acid
metabolite
stereoisomer
isotopomer
Mesaconic acid
E-
ambient
1 metabolite(s)
Replica of
Mesaconic acid
reference substance
supplier
supplier code
lot
Mesaconic acid
Aldrich
13,104-4
Mesaconic acid
Aldrich
13,104-0
S02029-044
2 reference substance(s)
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 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.
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