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2-deoxy-D-gluconate

PropertiesImage
MNX_IDMNXM3460 Image of MNXM3460
referencechebi:57653
formulaC6H11O6
global charge-1
mol weight179.148
InChIKeyPALQXFMLVVWXFD-KODRXGBYSA-M
InChIInChI=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
SMILESO=C([O-])C[C@@H](O)[C@H](O)[C@H](O)CO
MNX internals
InChI (mnx)InChI=1/C6H12O6/c7-2-4(9)6(12)3(8)1-5(10)11/h3-4,6-9,12H,1-2H2,(H,10,11)/t3-,4-,6+/m1/s1 Image of MNXM3460
SMILES (mnx)[CH2:1]([C@H:3]([C@@H:6]([C@@H:4]([CH2:2][OH:7])[OH:9])[OH:12])[OH:8])[C:5](=[O:10])[OH:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57653
chebi:57653
PALQXFMLVVWXFD-KODRXGBYSA-M 		2-deoxy-D-gluconate
(3R,4S,5R)-3,4,5,6-tetrahydroxyhexanoate
2-deoxy-D-gluconate anion

bigg.metabolite:2dglcn
biggM:2dglcn
kegg.compound:C02782
keggC:C02782
PALQXFMLVVWXFD-KODRXGBYSA-N 		2-Deoxy-D-gluconate

seed.compound:cpd01795
seedM:cpd01795
PALQXFMLVVWXFD-KODRXGBYSA-M 		2-Deoxy-D-gluconate
2-deoxy-D-gluconate
2-deoxy-D-gluconic acid
2-deoxygluconate
2-deoxygluconic acid
2dglcn
D-arabino-Hexonic acid, 2-deoxy-
de-O-gluconate

metacyc.compound:DE-O-GLUCONATE
metacycM:DE-O-GLUCONATE
PALQXFMLVVWXFD-KODRXGBYSA-M 		2-deoxy-D-gluconate
2-deoxy-D-arabino-hexonate
2-deoxy-D-gluconic acid
2-deoxygluconate

CHEBI:16138
chebi:16138
PALQXFMLVVWXFD-KODRXGBYSA-N 		2-deoxy-D-gluconic acid
2-Deoxy-D-gluconate

chebi:1077
chebi:11564
biggM:M_2dglcn
keggC:M_C02782
seedM:M_cpd01795 		secondary/obsolete/fantasy identifier