Chem
J-GLOBAL ID：200907046235243180   Nikkaji number：J2.144.279H

Ethyl 3-O-acetyl-4-O,6-O-(4-methoxybenzylidene)-2-(1,3-dioxo-1,3-dihydro-2H-isoindole-2-yl)-2-deoxy-1-thio-β-D-glucopyranoside

エチル3-O-アセチル-4-O,6-O-(4-メトキシベンジリデン)-2-(1,3-ジオキソ-1,3-ジヒドロ-2H-イソインドール-2-イル)-2-デオキシ-1-チオ-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： C26H27NO8S
Molecular formula furigana： C26-H27-N-O8-S
Molecular weight： 513.559
InChI： InChI=1S/C26H27NO8S/c1-4-36-26-20(27-23(29)17-7-5-6-8-18(17)24(27)30)22(33-14(2)28)21-19(34-26)13-32-25(35-21)15-9-11-16(31-3)12-10-15/h5-12,19-22,25-26H,4,13H2,1-3H3/t19-,20-,21-,22-,25?,26+/m1/s1
InChI key： UQZZZUFGGGORQU-MQKRSKODSA-N
SMILES： CCS[C@@H]1O[C@@H]2COC(O[C@H]2[C@H](OC(=O)C)[C@H]1N1C(=O)c2ccccc2C1=O)c1ccc(OC)cc1
Systematic name  (3)：
  • エチル3-O-アセチル-4-O,6-O-(4-メトキシベンジリデン)-2-(1,3-ジオキソ-1,3-ジヒドロ-2H-イソインドール-2-イル)-2-デオキシ-1-チオ-β-D-グルコピラノシド
  • (4aR,6S,7R,8R,8aS)-7-(1,3-ジオキソ-2,3-ジヒドロ-1H-イソインドール-2-イル)-6-(エチルスルファニル)-2-(4-メトキシフェニル)-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,8R,8aS)-7-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-6-(ethylsulfanyl)-2-(4-methoxyphenyl)-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-8-yl acetate
Other name (1)：
  • Ethyl 3-O-acetyl-4-O,6-O-(4-methoxybenzylidene)-2-(1,3-dioxo-1,3-dihydro-2H-isoindole-2-yl)-2-deoxy-1-thio-β-D-glucopyranoside
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