Chem
J-GLOBAL ID:200907038911187741   Nikkaji number:J2.052.481B

Allyl 3-O-(2-O,3-O,4-O-tribenzyl-α-D-glucopyranosyl)-4-O,6-O-benzylidene-2-(acetylamino)-2-deoxy-α-D-glucopyranoside

アリル3-O-(2-O,3-O,4-O-トリベンジル-α-D-グルコピラノシル)-4-O,6-O-ベンジリデン-2-(アセチルアミノ)-2-デオキシ-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: C45H51NO11
Molecular formula furigana: C45-H51-N-O11
Molecular weight: 781.899
InChI: InChI=1S/C45H51NO11/c1-3-24-49-44-37(46-30(2)48)40(39-36(55-44)29-53-43(56-39)34-22-14-7-15-23-34)57-45-42(52-28-33-20-12-6-13-21-33)41(51-27-32-18-10-5-11-19-32)38(35(25-47)54-45)50-26-31-16-8-4-9-17-31/h3-23,35-45,47H,1,24-29H2,2H3,(H,46,48)/t35-,36-,37-,38-,39-,40-,41+,42-,43?,44+,45-/m1/s1
InChI key: JZCAVMARMGYTFN-NCQAJDPCSA-N
SMILES: CC(=O)N[C@H]1[C@@H](OCC=C)O[C@@H]2COC(O[C@H]2[C@@H]1O[C@H]1O[C@H](CO)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1)c1ccccc1
Systematic name  (3):
  • アリル3-O-(2-O,3-O,4-O-トリベンジル-α-D-グルコピラノシル)-4-O,6-O-ベンジリデン-2-(アセチルアミノ)-2-デオキシ-α-D-グルコピラノシド
  • N-[(4aR,6S,7R,8R,8aS)-2-フェニル-6-(プロパ-2-エン-1-イルオキシ)-8-{[(2S,3R,4S,5R,6R)-3,4,5-トリス(ベンジルオキシ)-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン-7-イル]アセトアミド
  • N-[(4aR,6S,7R,8R,8aS)-2-phenyl-6-(prop-2-en-1-yloxy)-8-{[(2S,3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-(hydroxymethyl)oxan-2-yl]oxy}-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-7-yl]acetamide
Other name (1):
  • Allyl 3-O-(2-O,3-O,4-O-tribenzyl-α-D-glucopyranosyl)-4-O,6-O-benzylidene-2-(acetylamino)-2-deoxy-α-D-glucopyranoside
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