Chem
J-GLOBAL ID:200907065409711370
Nikkaji number:J2.539.200K
(2S,3R,5S,6R,8S,9R)-1-(4-Methylphenylsulfinyl)-3-acetoxy-8,10-[[(R)-benzylidene]bisoxy]-2,6:5,9-diepoxydecane
(2S,3R,5S,6R,8S,9R)-1-(4-メチルフェニルスルフィニル)-3-アセトキシ-8,10-[[(R)-ベンジリデン]ビスオキシ]-2,6:5,9-ジエポキシデカン
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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:
C26 H30 O7 S
Molecular formula furigana:
C26-H30-O7-S
Molecular weight:
486.580
InChI:
InChI=1S/C26H30O7S/c1-16-8-10-19(11-9-16)34(28)15-25-23(30-17(2)27)13-20-21(32-25)12-22-24(31-20)14-29-26(33-22)18-6-4-3-5-7-18/h3-11,20-26H,12-15H2,1-2H3/t20-,21+,22-,23+,24+,25+,26+,34?/m0/s1
InChI key:
RENANPABCKUYLL-QWARTXEQSA-N
SMILES:
CC(=O)O[C@@H]1C[C@@H]2O[C@@H]3CO[C@H](O[C@H]3C[C@H]2O[C@@H]1CS(=O)c1ccc(C)cc1)c1ccccc1
Systematic name (4):
(2S,3R,5S,6R,8S,9R)-1-(4-メチルフェニルスルフィニル)-3-アセトキシ-8,10-[[(R)-ベンジリデン]ビスオキシ]-2,6:5,9-ジエポキシデカン
(2R,4aα,8aβ,9aβ,10aα)-2α-フェニル-6β-アセトキシ-7β-(4-メチルフェニルスルフィニルメチル)オクタヒドロ-2H,5H-1,3,8,10-テトラオキサアントラセン
(1S,3R,6R,8S,10R,12S,13R)-12-[(4-メチルベンゼンスルフィニル)メチル]-6-フェニル-2,5,7,11-テトラオキサトリシクロ[8.4.0.03,8 ]テトラデカン-13-イル アセタート
(1S,3R,6R,8S,10R,12S,13R)-12-[(4-methylbenzenesulfinyl)methyl]-6-phenyl-2,5,7,11-tetraoxatricyclo[8.4.0.03,8 ]tetradecan-13-yl acetate
Other name (2):
(2S,3R,5S,6R,8S,9R)-1-(4-Methylphenylsulfinyl)-3-acetoxy-8,10-[[(R)-benzylidene]bisoxy]-2,6:5,9-diepoxydecane
(2R,4aα,8aβ,9aβ,10aα)-2α-Phenyl-6β-acetoxy-7β-(4-methylphenylsulfinylmethyl)octahydro-2H,5H-1,3,8,10-tetraoxaanthracene
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