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CHEBI:15670 - (E)-glutaconic acid

Default Structure
ChEBI IDCHEBI:15670
ChEBI Name(E)-glutaconic acid
Stars
ASCII Name(E)-glutaconic acid
DefinitionThe (E)-isomer of glutaconic acid.
Secondary ChEBI IDsCHEBI:280, CHEBI:18631
Last Modified23 October 2015
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC5H6O4
Net Charge0
Average Mass130.099
Monoisotopic Mass130.02661
SMILESO=C(O)/C=C/CC(=O)O
InChIInChI=1S/C5H6O4/c6-4(7)2-1-3-5(8)9/h1-2H,3H2,(H,6,7)(H,8,9)/b2-1+
InChIKeyXVOUMQNXTGKGMA-OWOJBTEDSA-N
Wikipedia
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
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)
(E)-glutaconic acid (CHEBI:15670) is a glutaconic acid (CHEBI:24309)
(E)-glutaconic acid (CHEBI:15670) is conjugate acid of (E)-glutaconate(1−) (CHEBI:36461)
Incoming Relation(s)
(E)-3-methylglutaconic acid (CHEBI:37245) has functional parent (E)-glutaconic acid (CHEBI:15670)
O-glutaconylcarnitine (CHEBI:86081) has functional parent (E)-glutaconic acid (CHEBI:15670)
trans-4-carboxybut-2-enoyl-CoA (CHEBI:15497) has functional parent (E)-glutaconic acid (CHEBI:15670)
(E)-glutaconate(1−) (CHEBI:36461) is conjugate base of (E)-glutaconic acid (CHEBI:15670)
IUPAC Name 
(2E)-pent-2-enedioic acid
Synonyms  Source
(E)-GlutaconateKEGG COMPOUND
(E)-glutaconic acidChEBI
Glutaconic acidKEGG COMPOUND
trans-GlutaconateKEGG COMPOUND
trans-Glutaconic acidKEGG COMPOUND
Manual XrefsDatabases
C02214KEGG COMPOUND
GLUTACONATEMetaCyc
Glutaconic_acidWikipedia
HMDB0000620HMDB
LMFA01170109LIPID MAPS
Registry NumbersSources
Reaxys:1722686Reaxys
CAS:628-48-8KEGG COMPOUND