CHEBI:64908 - (3E)-2-oxohex-3-enedioate

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ChEBI Name (3E)-2-oxohex-3-enedioate
ChEBI ID CHEBI:64908
ChEBI ASCII Name (3E)-2-oxohex-3-enedioate
Definition 2-Oxohex-3-enedioate in which the C=C double bond has E configuration; principal microspecies at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C6H4O5
Net Charge -2
Average Mass 156.09300
Monoisotopic Mass 156.00697
InChI InChI=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+
InChIKey QTHJXLFFFTVYJC-OWOJBTEDSA-L
SMILES [O-]C(=O)C\C=C\C(=O)C([O-])=O
ChEBI Ontology
Outgoing (3E)-2-oxohex-3-enedioate (CHEBI:64908) is a 2-oxohex-3-enedioate (CHEBI:64928)
(3E)-2-oxohex-3-enedioate (CHEBI:64908) is conjugate base of (3E)-2-oxohex-3-enedioic acid (CHEBI:64031)
Incoming (3E)-2-oxohex-3-enedioic acid (CHEBI:64031) is conjugate acid of (3E)-2-oxohex-3-enedioate (CHEBI:64908)
IUPAC Name
(3E)-2-oxohex-3-enedioate
Synonym Source
(3E)-2-oxohex-3-enedioate UniProt
Manual Xref Database
CPD-8742 MetaCyc
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Registry Number Type Source
4310323 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
19717587 PubMed citation SUBMITTER
Last Modified
18 June 2012