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CHEBI:57949 - 6-phosphonato-5-dehydro-2-deoxy-D-gluconate(3−)

ChEBI IDCHEBI:57949
ChEBI Name6-phosphonato-5-dehydro-2-deoxy-D-gluconate(3−)
Stars
ASCII Name6-phosphonato-5-dehydro-2-deoxy-D-gluconate(3-)
DefinitionTrianion of 6-phospho-5-dehydro-2-deoxy-D-gluconic acid arising from deprotonation of the carboxy and phosphate groups; major species at pH 7.3.
Last Modified7 July 2015
DownloadsMolfile
FormulaC6H8O9P
Net Charge-3
Average Mass255.095
Monoisotopic Mass254.99224
SMILESO=C([O-])C[C@@H](O)[C@H](O)C(=O)COP(=O)([O-])[O-]
InChIInChI=1S/C6H11O9P/c7-3(1-5(9)10)6(11)4(8)2-15-16(12,13)14/h3,6-7,11H,1-2H2,(H,9,10)(H2,12,13,14)/p-3/t3-,6+/m1/s1
InChIKeyOLUPOJQIFXQXIT-CVYQJGLWSA-K
ChEBI Ontology
Outgoing Relation(s)
6-phosphonato-5-dehydro-2-deoxy-D-gluconate(3−) (CHEBI:57949) is a 5-oxo monocarboxylic acid anion (CHEBI:35975)
6-phosphonato-5-dehydro-2-deoxy-D-gluconate(3−) (CHEBI:57949) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
6-phosphonato-5-dehydro-2-deoxy-D-gluconate(3−) (CHEBI:57949) is a organophosphate oxoanion (CHEBI:58945)
6-phosphonato-5-dehydro-2-deoxy-D-gluconate(3−) (CHEBI:57949) is conjugate base of 6-phospho-5-dehydro-2-deoxy-D-gluconic acid (CHEBI:16925)
Incoming Relation(s)
6-phospho-5-dehydro-2-deoxy-D-gluconic acid (CHEBI:16925) is conjugate acid of 6-phosphonato-5-dehydro-2-deoxy-D-gluconate(3−) (CHEBI:57949)
IUPAC Name 
2-deoxy-6-O-phosphonato-D-threo-hex-5-ulosonate
Synonyms  Source
6-phosphonato-5-dehydro-2-deoxy-D-gluconate trianionChEBI
(3R,4S)-3,4-dihydroxy-5-oxo-6-(phosphonatooxy)hexanoateIUPAC
6-phosphonato-5-dehydro-2-deoxy-D-gluconateChEBI
UniProt Name  Source
6-phospho-5-dehydro-2-deoxy-D-gluconateUniProt