Chem
J-GLOBAL ID:200907056793471420   Nikkaji number:J2.112.474E

Methyl 3-O-(2-O,3-O,4-O,6-O-tetraacetyl-α-D-mannopyranosyl)-2-O-acetyl-6-O-(tert-butyldiphenylsilyl)-α-D-mannopyranoside

メチル3-O-(2-O,3-O,4-O,6-O-テトラアセチル-α-D-マンノピラノシル)-2-O-アセチル-6-O-(tert-ブチルジフェニルシリル)-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: C39H52O16Si
Molecular formula furigana: C39-H52-O16-SI
Molecular weight: 804.914
InChI: InChI=1S/C39H52O16Si/c1-22(40)47-20-30-32(49-23(2)41)34(50-24(3)42)36(52-26(5)44)38(54-30)55-33-31(45)29(53-37(46-9)35(33)51-25(4)43)21-48-56(39(6,7)8,27-16-12-10-13-17-27)28-18-14-11-15-19-28/h10-19,29-38,45H,20-21H2,1-9H3/t29-,30-,31-,32-,33+,34+,35+,36+,37+,38-/m1/s1
InChI key: BFCZOUZNUHVZLS-LBDXPPCGSA-N
SMILES: CO[C@H]1O[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@@H](O)[C@H](O[C@H]2O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@H]2OC(=O)C)[C@@H]1OC(=O)C
Systematic name  (3):
  • メチル3-O-(2-O,3-O,4-O,6-O-テトラアセチル-α-D-マンノピラノシル)-2-O-アセチル-6-O-(tert-ブチルジフェニルシリル)-α-D-マンノピラノシド
  • [(2R,3R,4S,5S,6R)-3,4,5-トリス(アセチルオキシ)-6-{[(2S,3S,4S,5R,6R)-3-(アセチルオキシ)-6-{[(tert-ブチルジフェニルシリル)オキシ]メチル}-5-ヒドロキシ-2-メトキシオキサン-4-イル]オキシ}オキサン-2-イル]メチル アセタート
  • [(2R,3R,4S,5S,6R)-3,4,5-tris(acetyloxy)-6-{[(2S,3S,4S,5R,6R)-3-(acetyloxy)-6-{[(tert-butyldiphenylsilyl)oxy]methyl}-5-hydroxy-2-methoxyoxan-4-yl]oxy}oxan-2-yl]methyl acetate
Other name (1):
  • Methyl 3-O-(2-O,3-O,4-O,6-O-tetraacetyl-α-D-mannopyranosyl)-2-O-acetyl-6-O-(tert-butyldiphenylsilyl)-α-D-mannopyranoside
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