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CHEBI:58114 - 2-carboxylato-cis,cis-muconate(3−)

ChEBI IDCHEBI:58114
ChEBI Name2-carboxylato-cis,cis-muconate(3−)
Stars
ASCII Name2-carboxylato-cis,cis-muconate(3-)
DefinitionTricarboxylate anion of 2-carboxylato-cis,cis-muconic acid; major species at pH 7.3.
Last Modified2 May 2017
DownloadsMolfile
FormulaC7H3O6
Net Charge-3
Average Mass183.095
Monoisotopic Mass182.99461
SMILESO=C([O-])/C=C\C=C(C(=O)[O-])C(=O)[O-]
InChIInChI=1S/C7H6O6/c8-5(9)3-1-2-4(6(10)11)7(12)13/h1-3H,(H,8,9)(H,10,11)(H,12,13)/p-3/b3-1-
InChIKeySLUDRBHRUDRZJZ-IWQZZHSRSA-K
ChEBI Ontology
Outgoing Relation(s)
2-carboxylato-cis,cis-muconate(3−) (CHEBI:58114) is a tricarboxylic acid trianion (CHEBI:27092)
2-carboxylato-cis,cis-muconate(3−) (CHEBI:58114) is conjugate base of 2-carboxy-cis,cis-muconic acid (CHEBI:17344)
Incoming Relation(s)
2-carboxy-cis,cis-muconic acid (CHEBI:17344) is conjugate acid of 2-carboxylato-cis,cis-muconate(3−) (CHEBI:58114)
IUPAC Name 
(3Z)-buta-1,3-diene-1,1,4-tricarboxylate
Synonyms  Source
2-carboxylato-cis,cis-muconateChEBI
2-carboxylato-cis,cis-muconate trianionChEBI
UniProt Name  Source
2-carboxy-cis,cis-muconateUniProt