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CHEBI:79172 - 2-hydroxy-6-(2-oxidophenyl)-6-oxo-cis,cis-hexa-2,4-dienoate(2−)

ChEBI IDCHEBI:79172
ChEBI Name2-hydroxy-6-(2-oxidophenyl)-6-oxo-cis,cis-hexa-2,4-dienoate(2−)
Stars
ASCII Name2-hydroxy-6-(2-oxidophenyl)-6-oxo-cis,cis-hexa-2,4-dienoate(2-)
DefinitionA hydroxy monocarboxylic acid anion obtained by deprotonation of the carboxy and phenol groups of 2-hydroxy-6-(2-hydroxyphenyl)-6-oxo-cis,cis-hexa-2,4-dienoic acid. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified29 September 2014
SubmitterAnne Morgat
DownloadsMolfile
FormulaC12H8O5
Net Charge-2
Average Mass232.191
Monoisotopic Mass232.03827
SMILESO=C([O-])/C(O)=C\C=C/C(=O)c1ccccc1[O-]
InChIInChI=1S/C12H10O5/c13-9-5-2-1-4-8(9)10(14)6-3-7-11(15)12(16)17/h1-7,13,15H,(H,16,17)/p-2/b6-3-,11-7+
InChIKeyMWGXDZHCLRMDFE-TZFLZTJBSA-L
ChEBI Ontology
Outgoing Relation(s)
2-hydroxy-6-(2-oxidophenyl)-6-oxo-cis,cis-hexa-2,4-dienoate(2−) (CHEBI:79172) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
2-hydroxy-6-(2-oxidophenyl)-6-oxo-cis,cis-hexa-2,4-dienoate(2−) (CHEBI:79172) is a phenolate anion (CHEBI:50525)
2-hydroxy-6-(2-oxidophenyl)-6-oxo-cis,cis-hexa-2,4-dienoate(2−) (CHEBI:79172) is conjugate base of 2-hydroxy-6-(2-hydroxyphenyl)-6-oxo-cis,cis-hexa-2,4-dienoate (CHEBI:36538)
Incoming Relation(s)
2-hydroxy-6-(2-hydroxyphenyl)-6-oxo-cis,cis-hexa-2,4-dienoate (CHEBI:36538) is conjugate acid of 2-hydroxy-6-(2-oxidophenyl)-6-oxo-cis,cis-hexa-2,4-dienoate(2−) (CHEBI:79172)
IUPAC Name 
(2E,4Z)-2-hydroxy-6-(2-oxidophenyl)-6-oxohexa-2,4-dienoate
UniProt Name  Source
2-hydroxy-6-(2-hydroxyphenyl)-6-oxo-cis,cis-hexa-2,4-dienoateUniProt