Chem
J-GLOBAL ID：200907001246533071   Nikkaji number：J2.741.798A

4-Methoxyphenyl 2-O-benzyl-3-O-(2-O,3-O,4-O,6-O-tetrabenzyl-β-D-mannopyranuronosyl)-4-O,6-O-benzylidene-β-D-galactopyranoside

4-メトキシフェニル2-O-ベンジル-3-O-(2-O,3-O,4-O,6-O-テトラベンジル-β-D-マンノピラヌロノシル)-4-O,6-O-ベンジリデン-β-D-ガラクトピラノシド
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： C61H60O13
Molecular formula furigana： C61-H60-O13
Molecular weight： 1001.138
InChI： InChI=1S/C61H60O13/c1-63-48-32-34-49(35-33-48)70-60-57(67-39-45-26-14-5-15-27-45)54(51-50(71-60)41-69-59(72-51)47-30-18-7-19-31-47)73-61-56(66-38-44-24-12-4-13-25-44)53(65-37-43-22-10-3-11-23-43)52(64-36-42-20-8-2-9-21-42)55(74-61)58(62)68-40-46-28-16-6-17-29-46/h2-35,50-57,59-61H,36-41H2,1H3/t50-,51+,52+,53+,54+,55+,56+,57-,59?,60-,61-/m1/s1
InChI key： OWEZJXKZUBNUPW-WALJIUPDSA-N
SMILES： COc1ccc(O[C@@H]2O[C@@H]3COC(O[C@@H]3[C@H](O[C@@H]3O[C@@H]([C@@H](OCc4ccccc4)[C@H](OCc4ccccc4)[C@@H]3OCc3ccccc3)C(=O)OCc3ccccc3)[C@H]2OCc2ccccc2)c2ccccc2)cc1
Systematic name  (3)：
  • 4-メトキシフェニル2-O-ベンジル-3-O-(2-O,3-O,4-O,6-O-テトラベンジル-β-D-マンノピラヌロノシル)-4-O,6-O-ベンジリデン-β-D-ガラクトピラノシド
  • ベンジル (2S,3S,4S,5S,6R)-6-{[(4aR,6S,7R,8S,8aS)-7-(ベンジルオキシ)-6-(4-メトキシフェノキシ)-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}-3,4,5-トリス(ベンジルオキシ)オキサン-2-カルボキシラート
  • benzyl (2S,3S,4S,5S,6R)-6-{[(4aR,6S,7R,8S,8aS)-7-(benzyloxy)-6-(4-methoxyphenoxy)-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-8-yl]oxy}-3,4,5-tris(benzyloxy)oxane-2-carboxylate
Other name (1)：
  • 4-Methoxyphenyl 2-O-benzyl-3-O-(2-O,3-O,4-O,6-O-tetrabenzyl-β-D-mannopyranuronosyl)-4-O,6-O-benzylidene-β-D-galactopyranoside
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