MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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D-glucosone

	Properties	Image
MNX_ID	MNXM7244
reference	chebi:52417
formula	C₆H₁₀O₆
global charge	0
mol weight	178.14
InChIKey	DCNMIDLYWOTSGK-HSUXUTPPSA-N
InChI	InChI=1S/C6H10O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,4-6,8,10-12H,2H2/t4-,5-,6-/m1/s1
SMILES	O=CC(=O)[C@@H](O)[C@H](O)[C@H](O)CO

MNX internals

InChI (mnx)	InChI=1/C6H10O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,4-6,8,10-12H,2H2/t4-,5-,6-/m1/s1
SMILES (mnx)	[CH:1]([C:3]([C@H:5]([C@@H:6]([C@@H:4]([CH2:2][OH:8])[OH:10])[OH:12])[OH:11])=[O:9])=[O:7]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	14
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:52417 chebi:52417 DCNMIDLYWOTSGK-HSUXUTPPSA-N	D-glucosone 2-Ketoglucose D-arabino-hexos-2-ulose
hmdb:HMDB0029932 DCNMIDLYWOTSGK-HSUXUTPPSA-N	D-Arabino-hexos-2-ulose (3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexanal 2-Ketoglucose Arabino-hexos-2-ulose Arabino-hexosulose D-Arabino-2-hexosulose D-Glucosone D-glucosone Galactosone Glucosone Glucosone, D isomer
sabiork.compound:28057 sabiorkM:28057 kegg.compound:C22525 keggC:C22525 DCNMIDLYWOTSGK-HSUXUTPPSA-N	D-Glucosone
metacyc.compound:CPD-13129 metacycM:CPD-13129 seed.compound:cpd23747 seedM:cpd23747 DCNMIDLYWOTSGK-HSUXUTPPSA-N	D-glucosone D-arabino-hexos-2-ulose aldehydo-2-dehydro-D-glucose aldehydo-2-keto-D-glucose
sabiork.compound:22910 sabiorkM:22910 DCNMIDLYWOTSGK-HSUXUTPPSA-N	Glucosone
envipath:...eecd235b55b6 envipathM:...eecd235b55b6 DCNMIDLYWOTSGK-HSUXUTPPSA-N	compound 0066487
hmdb:HMDB29932 keggC:M_C22525 seedM:M_cpd23747	secondary/obsolete/fantasy identifier