Chem
J-GLOBAL ID:201107023117628874   Nikkaji number:J2.984.499B

p-Tolyl 2-O,3-O-dibenzyl-4-O,6-O-diacetyl-1-thio-α-D-mannopyranoside

p-トリル2-O,3-O-ジベンジル-4-O,6-O-ジアセチル-1-チオ-α-D-マンノピラノシド
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C31H34O7S
Molecular formula furigana: C31-H34-O7-S
Molecular weight: 550.670
InChI: InChI=1S/C31H34O7S/c1-21-14-16-26(17-15-21)39-31-30(36-19-25-12-8-5-9-13-25)29(35-18-24-10-6-4-7-11-24)28(37-23(3)33)27(38-31)20-34-22(2)32/h4-17,27-31H,18-20H2,1-3H3/t27-,28-,29+,30+,31-/m1/s1
InChI key: QWQGIVFJZWRWOY-ZOROSQJXSA-N
SMILES: CC(=O)OC[C@H]1O[C@H](Sc2ccc(C)cc2)[C@@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OC(=O)C
Systematic name  (4):
  • 1-S-(4-メチルフェニル)-2-O,3-O-ジベンジル-4-O,6-O-ジアセチル-1-チオ-α-D-マンノピラノース
  • p-トリル2-O,3-O-ジベンジル-4-O,6-O-ジアセチル-1-チオ-α-D-マンノピラノシド
  • [(2R,3R,4S,5S,6R)-3-(アセチルオキシ)-4,5-ビス(ベンジルオキシ)-6-[(4-メチルフェニル)スルファニル]オキサン-2-イル]メチル アセタート
  • [(2R,3R,4S,5S,6R)-3-(acetyloxy)-4,5-bis(benzyloxy)-6-[(4-methylphenyl)sulfanyl]oxan-2-yl]methyl acetate
Other name (2):
  • 1-S-(4-Methylphenyl)-2-O,3-O-dibenzyl-4-O,6-O-diacetyl-1-thio-α-D-mannopyranose
  • p-Tolyl 2-O,3-O-dibenzyl-4-O,6-O-diacetyl-1-thio-α-D-mannopyranoside
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