Chem
J-GLOBAL ID：200907027920047659   Nikkaji number：J1.248.398H

3,4-Bis(benzyloxy)phenethyl 4-O-[(E)-3,4-bis(benzyloxy)cinnamoyl]-2-O,6-O-diacetyl-3-O-allyl-β-D-glucopyranoside

3,4-ビス(ベンジルオキシ)フェネチル4-O-[(E)-3,4-ビス(ベンジルオキシ)シンナモイル]-2-O,6-O-ジアセチル-3-O-アリル-β-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： C58H58O13
Molecular formula furigana： C58-H58-O13
Molecular weight： 963.089
InChI： InChI=1S/C58H58O13/c1-4-32-62-56-55(71-54(61)30-27-43-25-28-49(65-36-45-17-9-5-10-18-45)51(34-43)67-38-47-21-13-7-14-22-47)53(40-64-41(2)59)70-58(57(56)69-42(3)60)63-33-31-44-26-29-50(66-37-46-19-11-6-12-20-46)52(35-44)68-39-48-23-15-8-16-24-48/h4-30,34-35,53,55-58H,1,31-33,36-40H2,2-3H3/b30-27+/t53-,55-,56+,57-,58-/m1/s1
InChI key： XUKOHVWHKGHYFK-GNEAMEDOSA-N
SMILES： CC(=O)OC[C@H]1O[C@@H](OCCc2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)[C@H](OC(=O)C)[C@@H](OCC=C)[C@@H]1OC(=O)/C=C/c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
Systematic name  (3)：
  • 3,4-ビス(ベンジルオキシ)フェネチル4-O-[(E)-3,4-ビス(ベンジルオキシ)シンナモイル]-2-O,6-O-ジアセチル-3-O-アリル-β-D-グルコピラノシド
  • (2R,3R,4S,5R,6R)-5-(アセチルオキシ)-2-[(アセチルオキシ)メチル]-6-{2-[3,4-ビス(ベンジルオキシ)フェニル]エトキシ}-4-(プロパ-2-エン-1-イルオキシ)オキサン-3-イル (2E)-3-[3,4-ビス(ベンジルオキシ)フェニル]プロパ-2-エノアート
  • (2R,3R,4S,5R,6R)-5-(acetyloxy)-2-[(acetyloxy)methyl]-6-{2-[3,4-bis(benzyloxy)phenyl]ethoxy}-4-(prop-2-en-1-yloxy)oxan-3-yl (2E)-3-[3,4-bis(benzyloxy)phenyl]prop-2-enoate
Other name (1)：
  • 3,4-Bis(benzyloxy)phenethyl 4-O-[(E)-3,4-bis(benzyloxy)cinnamoyl]-2-O,6-O-diacetyl-3-O-allyl-β-D-glucopyranoside
Thsaurus map：
Thesaurus Map

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