CHEBI:57653 - 2-deoxy-D-gluconate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-deoxy-D-gluconate
ChEBI ID CHEBI:57653
ChEBI ASCII Name 2-deoxy-D-gluconate
Definition The conjugate base of 2-deoxy-D-gluconic acid; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C6H11O6
Net Charge -1
Average Mass 179.148
Monoisotopic Mass 179.05611
InChI InChI=1S/C6H12O6/c7-2-4(9)6(12)3(8)1-5(10)11/h3-4,6-9,12H,1-2H2,(H,10,11)/p-1/t3-,4-,6+/m1/s1
InChIKey PALQXFMLVVWXFD-KODRXGBYSA-M
SMILES C(=O)(C[C@@H](O)[C@H](O)[C@H](O)CO)[O-]
ChEBI Ontology
Outgoing 2-deoxy-D-gluconate (CHEBI:57653) is a carbohydrate acid anion (CHEBI:33721)
2-deoxy-D-gluconate (CHEBI:57653) is conjugate base of 2-deoxy-D-gluconic acid (CHEBI:16138)
Incoming 2-deoxy-D-gluconic acid (CHEBI:16138) is conjugate acid of 2-deoxy-D-gluconate (CHEBI:57653)
IUPAC Name
2-deoxy-D-gluconate
Synonyms Sources
(3R,4S,5R)-3,4,5,6-tetrahydroxyhexanoate ChEBI
2-deoxy-D-gluconate UniProt
2-deoxy-D-gluconate anion ChEBI
Last Modified
22 January 2016