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CHEBI:24309 - glutaconic acid

ChEBI IDCHEBI:24309
ChEBI Nameglutaconic acid
Stars
DefinitionA pentenedioic acid that is pent-2-ene substituted by carboxy groups at positions 1 and 5.
Last Modified23 October 2015
DownloadsMolfile
FormulaC5H6O4
Net Charge0
Average Mass130.099
Monoisotopic Mass130.02661
SMILES[H]C(=CC(=O)O)CC(=O)O
InChIInChI=1S/C5H6O4/c6-4(7)2-1-3-5(8)9/h1-2H,3H2,(H,6,7)(H,8,9)
InChIKeyXVOUMQNXTGKGMA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (23859237)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
glutaconic acid (CHEBI:24309) has role human metabolite (CHEBI:77746)
glutaconic acid (CHEBI:24309) is a pentenedioic acid (CHEBI:36129)
glutaconic acid (CHEBI:24309) is conjugate acid of glutaconate(1−) (CHEBI:36462)
Incoming Relation(s)
glutaconyl-CoA (CHEBI:24311) has functional parent glutaconic acid (CHEBI:24309)
(E)-glutaconic acid (CHEBI:15670) is a glutaconic acid (CHEBI:24309)
(Z)-glutaconic acid (CHEBI:50429) is a glutaconic acid (CHEBI:24309)
glutaconate(1−) (CHEBI:36462) is conjugate base of glutaconic acid (CHEBI:24309)
IUPAC Name 
pent-2-enedioic acid
Synonyms  Source
2-Pentenedioic acidChemIDplus
Pent-2-ene-1,5-dioic acidChemIDplus
Glutaconic acidChemIDplus
Registry NumbersSources
Reaxys:1759560Reaxys
CAS:1724-02-3ChemIDplus
Citations