CHEBI:85256 - 3-dehydro-D-gluconate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-dehydro-D-gluconate
ChEBI ID CHEBI:85256
ChEBI ASCII Name 3-dehydro-D-gluconate
Definition A keto-D-gluconate that is the conjugate base of 3-dehydro-D-gluconic acid, obtained by deprotonation of the carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H9O7
Net Charge -1
Average Mass 193.13200
Monoisotopic Mass 193.035
InChI InChI=1S/C6H10O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-3,5,7-9,11H,1H2,(H,12,13)/p-1/t2-,3-,5-/m1/s1
InChIKey WTAHRPBPWHCMHW-PAKKCRSFSA-M
SMILES OC[C@@H](O)[C@@H](O)C(=O)[C@@H](O)C([O-])=O
ChEBI Ontology
Outgoing 3-dehydro-D-gluconate (CHEBI:85256) is a 3-oxo monocarboxylic acid anion (CHEBI:35973)
3-dehydro-D-gluconate (CHEBI:85256) is a keto-D-gluconate (CHEBI:24966)
3-dehydro-D-gluconate (CHEBI:85256) is conjugate base of 3-dehydro-D-gluconic acid (CHEBI:85257)
Incoming 3-dehydro-D-gluconic acid (CHEBI:85257) is conjugate acid of 3-dehydro-D-gluconate (CHEBI:85256)
IUPAC Name
D-ribo-hex-3-ulosonate
Synonyms Sources
3-keto-D-gluconate ChEBI
3-ketogluconate ChEBI
Last Modified
17 March 2015