Chem
J-GLOBAL ID：200907002266830486   Nikkaji number：J1.923.993D

Methyl 2-O,3-O-diacetyl-4-O,6-O-[α-[[(2-iodophenethyl)thio]carbonyl]benzylidene]-α-D-glucopyranoside

メチル2-O,3-O-ジアセチル-4-O,6-O-[α-[[(2-ヨードフェネチル)チオ]カルボニル]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： C27H29IO9S
Molecular formula furigana： C27-H29-I-O9-S
Molecular weight： 656.480
InChI： InChI=1S/C27H29IO9S/c1-16(29)34-23-22-21(36-25(32-3)24(23)35-17(2)30)15-33-27(37-22,19-10-5-4-6-11-19)26(31)38-14-13-18-9-7-8-12-20(18)28/h4-12,21-25H,13-15H2,1-3H3/t21-,22-,23+,24-,25+,27?/m1/s1
InChI key： FOUREBKXESDBMM-DFOFILADSA-N
SMILES： CO[C@H]1O[C@@H]2COC(O[C@H]2[C@H](OC(=O)C)[C@H]1OC(=O)C)(C(=O)SCCc1ccccc1I)c1ccccc1
Systematic name  (3)：
  • メチル2-O,3-O-ジアセチル-4-O,6-O-[α-[[(2-ヨードフェネチル)チオ]カルボニル]ベンジリデン]-α-D-グルコピラノシド
  • (4aR,6S,7R,8S,8aR)-7-(アセチルオキシ)-2-({[2-(2-ヨードフェニル)エチル]スルファニル}カルボニル)-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 アセタート
  • (4aR,6S,7R,8S,8aR)-7-(acetyloxy)-2-({[2-(2-iodophenyl)ethyl]sulfanyl}carbonyl)-6-methoxy-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-8-yl acetate
Other name (1)：
  • Methyl 2-O,3-O-diacetyl-4-O,6-O-[α-[[(2-iodophenethyl)thio]carbonyl]benzylidene]-α-D-glucopyranoside
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