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CHEBI:57713 - 3-(2-carboxylatoethenyl)-cis,cis-muconate(3−)

ChEBI IDCHEBI:57713
ChEBI Name3-(2-carboxylatoethenyl)-cis,cis-muconate(3−)
Stars
ASCII Name3-(2-carboxylatoethenyl)-cis,cis-muconate(3-)
DefinitionTricarboxylate anion of 3-(2-carboxyethenyl)-cis,cis-muconic acid; major species at pH 7.3.
Last Modified2 May 2017
DownloadsMolfile
FormulaC9H5O6
Net Charge-3
Average Mass209.133
Monoisotopic Mass209.01026
SMILESO=C([O-])C=C(/C=C\C(=O)[O-])/C=C\C(=O)[O-]
InChIInChI=1S/C9H8O6/c10-7(11)3-1-6(5-9(14)15)2-4-8(12)13/h1-5H,(H,10,11)(H,12,13)(H,14,15)/p-3/b3-1-,4-2-
InChIKeyWKDXBDTUVVLFQV-CCAGOZQPSA-K
ChEBI Ontology
Outgoing Relation(s)
3-(2-carboxylatoethenyl)-cis,cis-muconate(3−) (CHEBI:57713) is a tricarboxylic acid trianion (CHEBI:27092)
3-(2-carboxylatoethenyl)-cis,cis-muconate(3−) (CHEBI:57713) is conjugate base of 3-(2-carboxyethenyl)-cis,cis-muconic acid (CHEBI:16281)
Incoming Relation(s)
3-(2-carboxyethenyl)-cis,cis-muconic acid (CHEBI:16281) is conjugate acid of 3-(2-carboxylatoethenyl)-cis,cis-muconate(3−) (CHEBI:57713)
IUPAC Name 
(2Z,5Z)-4-(carboxylatomethylidene)hepta-2,5-dienedioate
Synonym  Source
3-(2-carboxylatoethenyl)-cis,cis-muconate trianionChEBI
UniProt Name  Source
3-(2-carboxyethenyl)-cis,cis-muconateUniProt