Chem
J-GLOBAL ID：200907068553583970   Nikkaji number：J2.539.202G

(2R,4aα,8aβ)-2α-Phenyl-6β-[(2S,3E)-2-acetoxy-4-(4-methylphenylsulfinyl)-3-butenyl]-7α-acetoxyhexahydropyrano[3,2-d]-1,3-dioxin

(2R,4aα,8aβ)-2α-フェニル-6β-[(2S,3E)-2-アセトキシ-4-(4-メチルフェニルスルフィニル)-3-ブテニル]-7α-アセトキシヘキサヒドロピラノ[3,2-d]-1,3-ジオキシン
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： C28H32O8S
Molecular formula furigana： C28-H32-O8-S
Molecular weight： 528.620
InChI： InChI=1S/C28H32O8S/c1-18-9-11-23(12-10-18)37(31)14-13-22(33-19(2)29)15-24-25(34-20(3)30)16-26-27(35-24)17-32-28(36-26)21-7-5-4-6-8-21/h4-14,22,24-28H,15-17H2,1-3H3/b14-13+/t22-,24+,25-,26+,27-,28-,37?/m1/s1
InChI key： TUPNRXQYACCZRQ-BEFAXSHRSA-N
SMILES： CC(=O)O[C@@H](C[C@@H]1O[C@@H]2CO[C@H](O[C@H]2C[C@H]1OC(=O)C)c1ccccc1)/C=C/S(=O)c1ccc(C)cc1
Systematic name  (3)：
  • (2R,4aα,8aβ)-2α-フェニル-6β-[(2S,3E)-2-アセトキシ-4-(4-メチルフェニルスルフィニル)-3-ブテニル]-7α-アセトキシヘキサヒドロピラノ[3,2-d]-1,3-ジオキシン
  • (2S,3E)-1-[(2R,4aR,6S,7R,8aS)-7-(アセチルオキシ)-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-6-イル]-4-(4-メチルベンゼンスルフィニル)ブタ-3-エン-2-イル アセタート
  • (2S,3E)-1-[(2R,4aR,6S,7R,8aS)-7-(acetyloxy)-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-6-yl]-4-(4-methylbenzenesulfinyl)but-3-en-2-yl acetate
Other name (1)：
  • (2R,4aα,8aβ)-2α-Phenyl-6β-[(2S,3E)-2-acetoxy-4-(4-methylphenylsulfinyl)-3-butenyl]-7α-acetoxyhexahydropyrano[3,2-d]-1,3-dioxin
Thsaurus map：
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