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CHEBI:58794 - (3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoate(2−)

ChEBI IDCHEBI:58794
ChEBI Name(3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoate(2−)
Stars
ASCII Name(3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoate(2-)
DefinitionDicarboxylate anion of (3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoic acid.
Last Modified12 June 2021
DownloadsMolfile
FormulaC11H6O5
Net Charge-2
Average Mass218.164
Monoisotopic Mass218.02262
SMILESO=C([O-])C(=O)/C=C\c1ccccc1C(=O)[O-]
InChIInChI=1S/C11H8O5/c12-9(11(15)16)6-5-7-3-1-2-4-8(7)10(13)14/h1-6H,(H,13,14)(H,15,16)/p-2/b6-5-
InChIKeyAPKXMKWCGDBYNV-WAYWQWQTSA-L
ChEBI Ontology
Outgoing Relation(s)
(3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoate(2−) (CHEBI:58794) is a oxo dicarboxylic acid dianion (CHEBI:133294)
(3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoate(2−) (CHEBI:58794) is conjugate base of (3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoic acid (CHEBI:49222)
Incoming Relation(s)
(3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoic acid (CHEBI:49222) is conjugate acid of (3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoate(2−) (CHEBI:58794)
IUPAC Name 
2-[(1Z)-3-carboxylato-3-oxoprop-1-en-1-yl]benzoate
UniProt Name  Source
(3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoateUniProt