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CHEBI:64011 - (3Z)-2-oxohex-3-enedioate

ChEBI IDCHEBI:64011
ChEBI Name(3Z)-2-oxohex-3-enedioate
Stars
ASCII Name(3Z)-2-oxohex-3-enedioate
Definition2-Oxohex-3-enedioate in which the C=C double bond has Z configuration; principal microspecies at pH 7.3.
Secondary ChEBI IDCHEBI:64015
Last Modified23 October 2013
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC6H4O5
Net Charge-2
Average Mass156.093
Monoisotopic Mass156.00697
SMILESO=C([O-])C/C=C\C(=O)C(=O)[O-]
InChIInChI=1S/C6H6O5/c7-4(6(10)11)2-1-3-5(8)9/h1-2H,3H2,(H,8,9)(H,10,11)/p-2/b2-1-
InChIKeyQTHJXLFFFTVYJC-UPHRSURJSA-L
ChEBI Ontology
Outgoing Relation(s)
(3Z)-2-oxohex-3-enedioate (CHEBI:64011) is a 2-oxohex-3-enedioate (CHEBI:64928)
(3Z)-2-oxohex-3-enedioate (CHEBI:64011) is conjugate base of (3Z)-2-oxohex-3-enedioic acid (CHEBI:64038)
Incoming Relation(s)
(3Z)-2-oxohex-3-enedioic acid (CHEBI:64038) is conjugate acid of (3Z)-2-oxohex-3-enedioate (CHEBI:64011)
Synonym  Source
(3Z)-5-oxohex-3-enedioateSUBMITTER
UniProt Name  Source
(3Z)-2-oxohex-3-enedioateUniProt
Citations