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nigerose

PropertiesImage
MNX_IDMNXM2409 Image of MNXM2409
referencechebi:7570
formulaC12H22O11
global charge0
mol weight342.297
InChIKeyQIGJYVCQYDKYDW-NSYYTRPSSA-N
InChIInChI=1S/C12H22O11/c13-1-3-5(15)7(17)8(18)12(22-3)23-10-6(16)4(2-14)21-11(20)9(10)19/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8-,9-,10+,11?,12-/m1/s1
SMILESOC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](CO)OC(O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C12H22O11/c13-1-3-5(15)7(17)8(18)12(22-3)23-10-6(16)4(2-14)21-11(20)9(10)19/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8-,9-,10+,11?,12-/m1/s1 Image of MNXM2409
SMILES (mnx)[CH2:1]([C@@H:3]1[C@@H:5]([OH:15])[C@H:7]([OH:17])[C@@H:8]([OH:18])[C@@H:12]([O:23][C@H:10]2[C@H:6]([OH:16])[C@@H:4]([CH2:2][OH:14])[O:21][CH:11]([OH:20])[C@@H:9]2[OH:19])[O:22]1)[OH:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:7570
chebi:7570
QIGJYVCQYDKYDW-NSYYTRPSSA-N
nigerose
3-O-alpha-D-glucopyranosyl-D-glucopyranose
Nigerose
Sakebiose
alpha-D-Glup-(1->3)-D-Glu
alpha-D-Glup-(1->3)-D-Glup
alpha-D-glucopyranosyl-(1->3)-D-glucopyranose

kegg.glycan:G00634
keggG:G00634
Nigerose

seed.compound:cpd01074
seedM:cpd01074
QIGJYVCQYDKYDW-NSYYTRPSSA-N
Nigerose
3-O-alpha-D-Glucopyranosyl-D-glucose
3-O-alpha-D-glucopyranosyl-D-glucopyranose
Sakebiose
alpha-1,3-glucose disaccharide
nigerose
sakebiose

kegg.compound:C01518
keggC:C01518
QIGJYVCQYDKYDW-NSYYTRPSSA-N
Nigerose
3-O-alpha-D-Glucopyranosyl-D-glucose
Sakebiose

sabiork.compound:5633
sabiorkM:5633
QIGJYVCQYDKYDW-NSYYTRPSSA-N
Nigerose
Sakebiose

metacyc.compound:3-BETA-D-GLUCOSYLGLUCOSE
metacycM:3-BETA-D-GLUCOSYLGLUCOSE
QIGJYVCQYDKYDW-NSYYTRPSSA-N
nigerose
3-O-alpha-D-glucopyranosyl-D-glucopyranose
alpha-1,3-glucose disaccharide
alpha-D-glucopyranosyl-(1->3)-D-glucopyranose
sakebiose

keggC:M_C01518
keggG:M_G00634
seedM:M_cpd01074
secondary/obsolete/fantasy identifier