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Details
cis-Aconitic acid
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mol
Role
Reference Substance
name
cis-Aconitic acid
MPIMP ID
R002105
stereoisomer
Z-
isotopomer
ambient
formula
C6H6O6
molecular mass
174.108
monoisotopic mass
174.01644
InChI
InChI=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-
InChIKey
GTZCVFVGUGFEME-IWQZZHSRSA-N
supplier
Avocado
supplier code
502-79821
lot
purity
solubility
general
amount
amount unit
store temperature 1
store temperature 2
store dry
store under argon
store in dark
contributing author
Tohge, RIKEN Plant Service Center, Metabolome Analysis Research Team, 1-7-22 Suehiro-cho, Tsurumi-ku, Yokohama, Kanagawa, 230-0045, JAPAN
date of order
date in
date out
date expired
box number
application/atom+xml
http://gmd-dev.mpimp-golm.mpg.de/REST/gmd.svc/ReferenceSubstance(guid%2730f2142f-6675-4d0d-9687-bc0bf739df43%27)
Synonyms of
cis-Aconitic acid
property
value
Beilstein
1725829
BRENDA
23413
CAS
585-84-2
ChEBI ID
ChEBI:32805
ChEBI ontology
is a aconitic acid
ChEBI ontology
is conjugate acid of cis-aconitate(3-)
ChemSpider ID
558863
MapMan
aconitate
PubChem CID
643757
PubChem SID
24890769
22 synonym(s)
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Metabolites mapped to
cis-Aconitic acid
metabolite
stereoisomer
isotopomer
cis-Aconitic acid
Z-
ambient
1 metabolite(s)
Replica of
cis-Aconitic acid
reference substance
supplier
supplier code
lot
cis-Aconitic acid
Sigma
A3412
091K5302
cis-Aconitic acid
Aldrich
122750
cis-Aconitic acid
Sigma
A3412
107H5234
cis-Aconitic acid
Sigma
A3412
4 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 9/24/2018 by Fehrle I., Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
modified by users
Hummel J., Fehrle I.
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