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5-dehydro-L-gluconate

PropertiesImage
MNX_IDMNXM114460 Image of MNXM114460
referencechebi:137108
formulaC6H9O7
global charge-1
mol weight193.131
InChIKeyIZSRJDGCGRAUAR-LMVFSUKVSA-M
InChIInChI=1S/C6H10O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h3-5,7,9-11H,1H2,(H,12,13)/p-1/t3-,4+,5-/m0/s1
SMILESO=C([O-])[C@@H](O)[C@H](O)[C@@H](O)C(=O)CO
MNX internals
InChI (mnx)InChI=1/C6H10O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h3-5,7,9-11H,1H2,(H,12,13)/t3-,4+,5-/m0/s1 Image of MNXM114460
SMILES (mnx)[CH2:1]([C:2]([C@@H:3]([C@H:4]([C@@H:5]([C:6](=[O:12])[OH:13])[OH:11])[OH:10])[OH:9])=[O:8])[OH:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:137108
chebi:137108
IZSRJDGCGRAUAR-LMVFSUKVSA-M 		5-dehydro-L-gluconate
5-keto-L-gluconate
L-5-ketogluconate
L-5-oxogluconate
L-xylo-hex-5-ulosonate

kegg.compound:C21644
keggC:C21644
IZSRJDGCGRAUAR-LMVFSUKVSA-N 		5-Dehydro-L-gluconate
5-Keto-L-gluconate

metacyc.compound:CPD-14806
metacycM:CPD-14806
seed.compound:cpd34961
seedM:cpd34961
IZSRJDGCGRAUAR-LMVFSUKVSA-M 		5-dehydro-L-gluconate
5-keto-L-gluconate
L-5-ketogluconate
L-5-oxogluconate

CHEBI:137932
chebi:137932
IZSRJDGCGRAUAR-LMVFSUKVSA-N 		5-dehydro-L-gluconic acid
5-keto-L-gluconic acid
L-5-ketogluconic acid
L-5-oxogluconic acid
L-xylo-hex-5-ulosonic acid

keggC:M_C21644
seedM:M_cpd34961 		secondary/obsolete/fantasy identifier