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(2S,3R)-dihydroxy-5-oxohexanedioate

PropertiesImage
MNX_IDMNXM146461 Image of MNXM146461
referencechebi:78267
formulaC6H6O7
global charge-2
mol weight190.107
InChIKeyQUURPCHWPQNNGL-FONMRSAGSA-L
InChIInChI=1S/C6H8O7/c7-2(4(9)6(12)13)1-3(8)5(10)11/h2,4,7,9H,1H2,(H,10,11)(H,12,13)/p-2/t2-,4+/m1/s1
SMILESO=C([O-])C(=O)C[C@@H](O)[C@H](O)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C6H8O7/c7-2(4(9)6(12)13)1-3(8)5(10)11/h2,4,7,9H,1H2,(H,10,11)(H,12,13)/t2-,4+/m1/s1 Image of MNXM146461
SMILES (mnx)[CH2:1]([C@H:2]([C@@H:4]([C:6](=[O:12])[OH:13])[OH:9])[OH:7])[C:3]([C:5]([OH:10])=[O:11])=[O:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:78267
chebi:78267
QUURPCHWPQNNGL-FONMRSAGSA-L 		(2S,3R)-dihydroxy-5-oxohexanedioate
2-keto-D-threo-4,5-dihydroxyadipate
3-deoxy-D-threo-hex-2-ulosarate
3-deoxy-D-threo-hex-2-ulosarate(2-)

kegg.compound:C21091
keggC:C21091
QUURPCHWPQNNGL-FONMRSAGSA-N 		(2S,3R)-2,3-Dihydroxy-5-oxohexanedioate
3-Deoxy-D-threo-hex-2-ulosarate

metacyc.compound:CPD-17670
metacycM:CPD-17670
seed.compound:cpd34416
seedM:cpd34416
QUURPCHWPQNNGL-FONMRSAGSA-L 		(2S,3R)-2,3-dihydroxy-5-oxohexanedioate
2-keto-D-threo-4,5-dihydroxyadipate
3-deoxy-(D)-threo-2-hexulosarate
3-deoxy-D-threo-hex-2-ulosarate

CHEBI:78709
chebi:78709
QUURPCHWPQNNGL-FONMRSAGSA-N 		3-deoxy-D-threo-hex-2-ulosaric acid
(2S,3R)-2,3-dihydroxy-5-oxohexanedioic acid
2-keto-D-threo-4,5-dihydroxyadipic acid

keggC:M_C21091
seedM:M_cpd34416 		secondary/obsolete/fantasy identifier