Chem
J-GLOBAL ID:200907068646466176   Nikkaji number:J2.543.408K

1-O,6-O-Dibenzoyl-3-O,4-O-isopropylidene-β-D-psicofuranosyl 2-O,3-O,4-O,6-O-tetrabenzyl-α-D-glucopyranoside

1-O,6-O-ジベンゾイル-3-O,4-O-イソプロピリデン-β-D-プシコフラノシル2-O,3-O,4-O,6-O-テトラベンジル-α-D-グルコピラノシド
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: C57H58O13
Molecular formula furigana: C57-H58-O13
Molecular weight: 951.078
InChI: InChI=1S/C57H58O13/c1-56(2)68-49-47(38-64-53(58)44-29-17-7-18-30-44)67-57(52(49)69-56,39-65-54(59)45-31-19-8-20-32-45)70-55-51(63-36-43-27-15-6-16-28-43)50(62-35-42-25-13-5-14-26-42)48(61-34-41-23-11-4-12-24-41)46(66-55)37-60-33-40-21-9-3-10-22-40/h3-32,46-52,55H,33-39H2,1-2H3/t46-,47-,48-,49-,50+,51-,52-,55-,57+/m1/s1
InChI key: YDJVPJKQHMDJLN-YQBWFPAPSA-N
SMILES: CC1(C)O[C@@H]2[C@@H](COC(=O)c3ccccc3)O[C@@](COC(=O)c3ccccc3)(O[C@H]3O[C@H](COCc4ccccc4)[C@@H](OCc4ccccc4)[C@H](OCc4ccccc4)[C@H]3OCc3ccccc3)[C@@H]2O1
Systematic name  (5):
  • 1-O,6-O-ジベンゾイル-3-O,4-O-イソプロピリデン-β-D-プシコフラノシル2-O,3-O,4-O,6-O-テトラベンジル-α-D-グルコピラノシド
  • 1-O,6-O-ジベンゾイル-2-O-(2-O,3-O,4-O,6-O-テトラベンジル-α-D-グルコピラノシル)-3-O,4-O-イソプロピリデン-β-D-プシコフラノース
  • 2-O-(2-O,3-O,4-O,6-O-テトラベンジル-α-D-グルコピラノシル)-1-O,6-O-ジベンゾイル-3-O,4-O-イソプロピリデン-β-D-プシコフラノース
  • [(3aR,4R,6S,6aR)-6-[(ベンゾイルオキシ)メチル]-2,2-ジメチル-6-{[(2R,3R,4S,5R,6R)-3,4,5-トリス(ベンジルオキシ)-6-[(ベンジルオキシ)メチル]オキサン-2-イル]オキシ}-テトラヒドロ-2H-フロ[3,4-d][1,3]ジオキソール-4-イル]メチル ベンゾアート
  • [(3aR,4R,6S,6aR)-6-[(benzoyloxy)methyl]-2,2-dimethyl-6-{[(2R,3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-[(benzyloxy)methyl]oxan-2-yl]oxy}-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]methyl benzoate
Other name (3):
  • 1-O,6-O-Dibenzoyl-3-O,4-O-isopropylidene-β-D-psicofuranosyl 2-O,3-O,4-O,6-O-tetrabenzyl-α-D-glucopyranoside
  • 1-O,6-O-Dibenzoyl-2-O-(2-O,3-O,4-O,6-O-tetrabenzyl-α-D-glucopyranosyl)-3-O,4-O-isopropylidene-β-D-psicofuranose
  • 2-O-(2-O,3-O,4-O,6-O-Tetrabenzyl-α-D-glucopyranosyl)-1-O,6-O-dibenzoyl-3-O,4-O-isopropylidene-β-D-psicofuranose
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