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2-deoxy-scyllo-inosamine

PropertiesImage
MNX_IDMNXM6700 Image of MNXM6700
referencechebi:65003
formulaC6H14NO4
global charge1
mol weight164.181
InChIKeyQXQNRSUOYNMXDL-KGJVWPDLSA-O
InChIInChI=1S/C6H13NO4/c7-2-1-3(8)5(10)6(11)4(2)9/h2-6,8-11H,1,7H2/p+1/t2-,3+,4+,5-,6-/m0/s1
SMILES[NH3+][C@H]1C[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C6H13NO4/c7-2-1-3(8)5(10)6(11)4(2)9/h2-6,8-11H,1,7H2/t2-,3+,4+,5-,6-/m0/s1 Image of MNXM6700
SMILES (mnx)[CH2:1]1[C@H:2]([NH2:7])[C@@H:4]([OH:9])[C@H:6]([OH:11])[C@@H:5]([OH:10])[C@@H:3]1[OH:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:65003
chebi:65003
QXQNRSUOYNMXDL-KGJVWPDLSA-O 		2-deoxy-scyllo-inosamine
(1R,2S,3S,4R,5S)-5-aminocyclohexane-1,2,3,4-tetrol
(1S,2R,3S,4S,5R)-2,3,4,5-tetrahydroxycyclohexanaminium
2-deoxy-scyllo-inosamine(1+)
2-deoxy-scyllo-inosaminium(1+)

kegg.compound:C17580
keggC:C17580
vmhM:2dsciam
vmhmetabolite:2dsciam
QXQNRSUOYNMXDL-KGJVWPDLSA-N 		2-Deoxy-scyllo-inosamine

seed.compound:cpd17701
seedM:cpd17701
QXQNRSUOYNMXDL-KGJVWPDLSA-O 		2-Deoxy-scyllo-inosamine
(1R,2S,3S,4R,5S)-5-aminocyclohexane-1,2,3,4-tetrol
1-amino-1,2-dideoxy-scyllo-inositol
2-deoxy-scyllo-inosamine

CHEBI:65046
chebi:65046
QXQNRSUOYNMXDL-KGJVWPDLSA-N 		2-deoxy-scyllo-inosamine
(1R,2S,3S,4R,5S)-5-aminocyclohexane-1,2,3,4-tetrol

metacyc.compound:CPD-14122
metacycM:CPD-14122
QXQNRSUOYNMXDL-KGJVWPDLSA-O 		2-deoxy-scyllo-inosamine
(1R,2S,3S,4R,5S)-5-aminocyclohexane-1,2,3,4-tetrol
1-amino-1,2-dideoxy-scyllo-inositol

keggC:M_C17580
seedM:M_cpd17701
vmhM:M_2dsciam 		secondary/obsolete/fantasy identifier