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CHEBI:57976 - 2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate

ChEBI IDCHEBI:57976
ChEBI Name2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate
Stars
DefinitionTrianion of 2-(carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid arising from deprotonation of the two carboxy groups as well as removal of the acidic proton at C2; major species at pH 7.3.
Last Modified15 April 2015
DownloadsMolfile
FormulaC7H3O6
Net Charge-3
Average Mass183.095
Monoisotopic Mass182.99461
SMILESO=C([O-])C[c-]1oc(=O)cc1C(=O)[O-]
InChIInChI=1S/C7H5O6/c8-5(9)2-4-3(7(11)12)1-6(10)13-4/h1H,2H2,(H,8,9)(H,11,12)/q-1/p-2
InChIKeyYTGSUEIQIFKYDP-UHFFFAOYSA-L
ChEBI Ontology
Outgoing Relation(s)
2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate (CHEBI:57976) is a dicarboxylic acid anion (CHEBI:35693)
2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate (CHEBI:57976) is conjugate base of 2-(carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid (CHEBI:16989)
Incoming Relation(s)
2-(carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid (CHEBI:16989) is conjugate acid of 2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate (CHEBI:57976)
IUPAC Name 
2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate
Synonyms  Source
2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate(3−)ChEBI
2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate trianionChEBI
UniProt Name  Source
3-carboxy-2,5-dihydro-5-oxofuran-2-acetateUniProt