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CHEBI:36986 - mesaconate(2−)

ChEBI IDCHEBI:36986
ChEBI Namemesaconate(2−)
Stars
ASCII Namemesaconate(2-)
DefinitionA dicarboxylic acid dianion that is the conjugate base of mesaconic acid.
Secondary ChEBI IDsCHEBI:11622, CHEBI:14584, CHEBI:19700
Last Modified17 September 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC5H4O4
Net Charge-2
Average Mass128.083
Monoisotopic Mass128.01206
SMILESC/C(=C\C(=O)[O-])C(=O)[O-]
InChIInChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/p-2/b3-2+
InChIKeyHNEGQIOMVPPMNR-NSCUHMNNSA-L
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
mesaconate(2−) (CHEBI:36986) has functional parent fumarate(2−) (CHEBI:29806)
mesaconate(2−) (CHEBI:36986) has role human metabolite (CHEBI:77746)
mesaconate(2−) (CHEBI:36986) has role plant metabolite (CHEBI:76924)
mesaconate(2−) (CHEBI:36986) is a dicarboxylic acid dianion (CHEBI:28965)
mesaconate(2−) (CHEBI:36986) is conjugate base of mesaconic acid (CHEBI:16600)
Incoming Relation(s)
mesaconic acid (CHEBI:16600) is conjugate acid of mesaconate(2−) (CHEBI:36986)
IUPAC Name 
(2E)-2-methylbut-2-enedioate
Synonyms  Source
2-MethylfumarateKEGG COMPOUND
MesaconateKEGG COMPOUND
methylfumarateChEBI
UniProt Name  Source
mesaconateUniProt
Manual XrefsDatabases
C01732KEGG COMPOUND