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CHEBI:57441 - 2,3-diketogulonate

ChEBI IDCHEBI:57441
ChEBI Name2,3-diketogulonate
Stars
DefinitionA dioxo monocarboxylic acid anion that is the conjugate base of 2,3-diketogulonic acid, and the major species at pH 7.3.
Last Modified18 October 2017
DownloadsMolfile
FormulaC6H7O7
Net Charge-1
Average Mass191.115
Monoisotopic Mass191.01973
SMILESO=C([O-])C(=O)C(=O)[C@H](O)[C@@H](O)CO
InChIInChI=1S/C6H8O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-3,7-9H,1H2,(H,12,13)/p-1/t2-,3+/m0/s1
InChIKeyGJQWCDSAOUMKSE-STHAYSLISA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
2,3-diketogulonate (CHEBI:57441) has role human metabolite (CHEBI:77746)
2,3-diketogulonate (CHEBI:57441) is a carbohydrate acid anion (CHEBI:33721)
2,3-diketogulonate (CHEBI:57441) is a dioxo monocarboxylic acid anion (CHEBI:35979)
2,3-diketogulonate (CHEBI:57441) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
2,3-diketogulonate (CHEBI:57441) is conjugate base of 2,3-diketogulonic acid (CHEBI:15622)
Incoming Relation(s)
2,3-diketogulonic acid (CHEBI:15622) is conjugate acid of 2,3-diketogulonate (CHEBI:57441)
IUPAC Names 
L-threo-hexo-2,3-diulosonate
(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoate
Synonyms  Source
2,3-diketo-L-gulonateChEBI
2,3-dioxo-L-gulonicChEBI
2,3-dioxo-L-gulonate(1−)ChEBI
UniProt Name  Source
2,3-dioxo-L-gulonateUniProt
Registry NumbersSources
Beilstein:3907464Beilstein
Citations