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CHEBI:58777 - 2-hydroxymethylglutarate

ChEBI IDCHEBI:58777
ChEBI Name2-hydroxymethylglutarate
Stars
DefinitionDicarboxylate anion of 2-hydroxymethylglutaric acid.
Last Modified16 September 2021
DownloadsMolfile
FormulaC6H8O5
Net Charge-2
Average Mass160.125
Monoisotopic Mass160.03827
SMILESO=C([O-])CCC(CO)C(=O)[O-]
InChIInChI=1S/C6H10O5/c7-3-4(6(10)11)1-2-5(8)9/h4,7H,1-3H2,(H,8,9)(H,10,11)/p-2
InChIKeyXPQIPNORJZZYPV-UHFFFAOYSA-L
ChEBI Ontology
Outgoing Relation(s)
2-hydroxymethylglutarate (CHEBI:58777) is a dicarboxylic acid dianion (CHEBI:28965)
2-hydroxymethylglutarate (CHEBI:58777) is conjugate base of 2-hydroxymethylglutaric acid (CHEBI:49077)
Incoming Relation(s)
(S)-2-hydroxymethylglutarate (CHEBI:180543) is a 2-hydroxymethylglutarate (CHEBI:58777)
2-hydroxymethylglutaric acid (CHEBI:49077) is conjugate acid of 2-hydroxymethylglutarate (CHEBI:58777)
IUPAC Name 
2-(hydroxymethyl)pentanedioate
UniProt Name  Source
2-(hydroxymethyl)glutarateUniProt
Registry NumbersSources
Beilstein:3665811Beilstein