Chem
J-GLOBAL ID：200907001775333339   Nikkaji number：J2.400.728F

Methyl 3-O-[3-O,6-O-diacetyl-4-O-benzyl-2-O-[(R)-α-(ethoxycarbonyl)benzyl]-β-D-glucopyranosyl]-2-O-benzyl-4-O,6-O-benzylidene-α-D-glucopyranoside

メチル3-O-[3-O,6-O-ジアセチル-4-O-ベンジル-2-O-[(R)-α-(エトキシカルボニル)ベンジル]-β-D-グルコピラノシル]-2-O-ベンジル-4-O,6-O-ベンジリデン-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： C48H54O15
Molecular formula furigana： C48-H54-O15
Molecular weight： 870.945
InChI： InChI=1S/C48H54O15/c1-5-53-45(51)38(34-22-14-8-15-23-34)61-44-41(58-31(3)50)39(55-26-32-18-10-6-11-19-32)36(28-54-30(2)49)60-48(44)63-42-40-37(29-57-46(62-40)35-24-16-9-17-25-35)59-47(52-4)43(42)56-27-33-20-12-7-13-21-33/h6-25,36-44,46-48H,5,26-29H2,1-4H3/t36-,37-,38-,39-,40-,41+,42+,43-,44-,46?,47+,48+/m1/s1
InChI key： DFSMNAQSDRZLTP-VCALUBJOSA-N
SMILES： CCOC(=O)[C@H](O[C@H]1[C@H](O[C@@H]2[C@@H](OCc3ccccc3)[C@@H](OC)O[C@@H]3COC(O[C@@H]23)c2ccccc2)O[C@H](COC(=O)C)[C@@H](OCc2ccccc2)[C@@H]1OC(=O)C)c1ccccc1
Systematic name  (3)：
  • メチル3-O-[3-O,6-O-ジアセチル-4-O-ベンジル-2-O-[(R)-α-(エトキシカルボニル)ベンジル]-β-D-グルコピラノシル]-2-O-ベンジル-4-O,6-O-ベンジリデン-α-D-グルコピラノシド
  • エチル (2R)-2-{[(2S,3R,4S,5R,6R)-2-{[(4aR,6S,7R,8S,8aR)-7-(ベンジルオキシ)-6-メトキシ-2-フェニル-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン-8-イル]オキシ}-4-(アセチルオキシ)-6-[(アセチルオキシ)メチル]-5-(ベンジルオキシ)オキサン-3-イル]オキシ}-2-フェニルアセタート
  • ethyl (2R)-2-{[(2S,3R,4S,5R,6R)-2-{[(4aR,6S,7R,8S,8aR)-7-(benzyloxy)-6-methoxy-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-8-yl]oxy}-4-(acetyloxy)-6-[(acetyloxy)methyl]-5-(benzyloxy)oxan-3-yl]oxy}-2-phenylacetate
Other name (1)：
  • Methyl 3-O-[3-O,6-O-diacetyl-4-O-benzyl-2-O-[(R)-α-(ethoxycarbonyl)benzyl]-β-D-glucopyranosyl]-2-O-benzyl-4-O,6-O-benzylidene-α-D-glucopyranoside
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