CHEBI:15622 - 2,3-diketogulonic acid

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ChEBI Name 2,3-diketogulonic acid
ChEBI ID CHEBI:15622
Definition A carbohydrate acid formally derived from gulonic acid by oxidation of the -OH groups at positions 2 and 3 to keto groups.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:10900, CHEBI:60793, CHEBI:226, CHEBI:18578
Supplier Information No supplier information found for this compound.
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Formulae C6H8O7
C6H8O7
Net Charge 0
Average Mass 192.12352
Monoisotopic Mass 192.02700
InChI InChI=1S/C6H8O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-3,7-9H,1H2,(H,12,13)/t2-,3+/m0/s1
InChIKey GJQWCDSAOUMKSE-STHAYSLISA-N
SMILES OC[C@H](O)[C@@H](O)C(=O)C(=O)C(O)=O
Metabolite of Species Details
Escherichia coli (NCBI:txid562) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2,3-diketogulonic acid (CHEBI:15622) has role Escherichia coli metabolite (CHEBI:76971)
2,3-diketogulonic acid (CHEBI:15622) is a α-diketone (CHEBI:51869)
2,3-diketogulonic acid (CHEBI:15622) is a carbohydrate acid (CHEBI:33720)
2,3-diketogulonic acid (CHEBI:15622) is a dioxo monocarboxylic acid (CHEBI:35951)
2,3-diketogulonic acid (CHEBI:15622) is a hydroxy monocarboxylic acid (CHEBI:35868)
2,3-diketogulonic acid (CHEBI:15622) is conjugate acid of 2,3-diketogulonate (CHEBI:57441)
Incoming 2,3-diketogulonate (CHEBI:57441) is conjugate base of 2,3-diketogulonic acid (CHEBI:15622)
IUPAC Names
(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoic acid
L-threo-hexo-2,3-diulosonic acid
Synonyms Sources
(4R,5S)-2,3-dioxo-4,5,6-trihydroxyhexanoic acid ChEBI
(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoate ChEBI
(4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoate KEGG COMPOUND
(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoic acid ChEBI
2,3-Diketo-L-gulonate KEGG COMPOUND
2,3-diketo-L-gulonic acid ChEBI
2,3-dioxo-2,3-dideoxy-L-gulonic acid ChEBI
2,3-L-diketogulonic acid ChEBI
diketo-L-gulonic acid ChEBI
L-threo-(2,3)-Hexodiulosonsäure ChEBI
L-threo-2,3-hexodiurosonic acid ChEBI
threo-2,3-Hexodiulosonic acid ChemIDplus
Manual Xref Database
C04575 KEGG COMPOUND
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Registry Numbers Types Sources
1711133 Beilstein Registry Number Beilstein
1711133 Reaxys Registry Number Reaxys
3409-57-2 CAS Registry Number ChemIDplus
Citation
Last Modified
23 December 2018