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CHEBI:58142 - 4-carboxy-2-hydroxy-cis,cis-muconate(3−)

ChEBI IDCHEBI:58142
ChEBI Name4-carboxy-2-hydroxy-cis,cis-muconate(3−)
Stars
ASCII Name4-carboxy-2-hydroxy-cis,cis-muconate(3-)
DefinitionA tricarboxylic acid trianion resulting from deprotonation of the three carboxy groups of 4-carboxy-2-hydroxy-cis,cis-muconic acid; major species at pH 7.3.
Last Modified11 April 2011
DownloadsMolfile
FormulaC7H3O7
Net Charge-3
Average Mass199.094
Monoisotopic Mass198.98952
SMILESO=C([O-])/C=C(\C=C(\O)C(=O)[O-])C(=O)[O-]
InChIInChI=1S/C7H6O7/c8-4(7(13)14)1-3(6(11)12)2-5(9)10/h1-2,8H,(H,9,10)(H,11,12)(H,13,14)/p-3/b3-2+,4-1+
InChIKeyQWLUKZXOQAQUFQ-DXLKSGPOSA-K
ChEBI Ontology
Outgoing Relation(s)
4-carboxy-2-hydroxy-cis,cis-muconate(3−) (CHEBI:58142) is a tricarboxylic acid trianion (CHEBI:27092)
4-carboxy-2-hydroxy-cis,cis-muconate(3−) (CHEBI:58142) is conjugate base of 4-carboxy-2-hydroxy-cis,cis-muconic acid (CHEBI:17424)
Incoming Relation(s)
4-carboxy-2-hydroxy-cis,cis-muconic acid (CHEBI:17424) is conjugate acid of 4-carboxy-2-hydroxy-cis,cis-muconate(3−) (CHEBI:58142)
IUPAC Name 
(1E,3E)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylate
Synonyms  Source
4-carboxy-2-hydroxy-cis,cis-muconate trianionChEBI
4-carboxy-2-hydroxy-cis,cis-muconateChEBI
UniProt Name  Source
4-carboxy-2-hydroxy-cis,cis-muconateUniProt