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CHEBI:78626 - 2-hydroxyhepta-2,4-dienedioate

ChEBI IDCHEBI:78626
ChEBI Name2-hydroxyhepta-2,4-dienedioate
Stars
DefinitionA dicarboxylic acid dianion obtained by deprotonation of the carboxy groups of 2-hydroxyhepta-2,4-dienedioic acid; major species at pH 7.3.
Last Modified16 September 2021
SubmitterAnne Morgat
DownloadsMolfile
FormulaC7H6O5
Net Charge-2
Average Mass170.120
Monoisotopic Mass170.02262
SMILESO=C([O-])C/C=C/C=C(\O)C(=O)[O-]
InChIInChI=1S/C7H8O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-3,8H,4H2,(H,9,10)(H,11,12)/p-2/b2-1+,5-3-
InChIKeyZBCBETMBSDTINL-WFTYEQLWSA-L
ChEBI Ontology
Outgoing Relation(s)
2-hydroxyhepta-2,4-dienedioate (CHEBI:78626) is a dicarboxylic acid dianion (CHEBI:28965)
2-hydroxyhepta-2,4-dienedioate (CHEBI:78626) is conjugate base of 2-hydroxyhepta-2,4-dienedioic acid (CHEBI:1162)
2-hydroxyhepta-2,4-dienedioate (CHEBI:78626) is tautomer of 2-oxohept-4-ene-1,7-dioate (CHEBI:78627)
Incoming Relation(s)
2-hydroxyhepta-2,4-dienedioic acid (CHEBI:1162) is conjugate acid of 2-hydroxyhepta-2,4-dienedioate (CHEBI:78626)
2-oxohept-4-ene-1,7-dioate (CHEBI:78627) is tautomer of 2-hydroxyhepta-2,4-dienedioate (CHEBI:78626)
IUPAC Name 
(2Z,4E)-2-hydroxyhepta-2,4-dienedioate
UniProt Name  Source
2-hydroxyhepta-2,4-dienedioateUniProt
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