Chem
J-GLOBAL ID：201007010758114933
Nikkaji number：J2.831.398E
(2S)-2β,3α-Diphenyl-5α-methoxy-2,3,6,6aα,7,10aα-hexahydro-5H-1,4-benzodioxocin-8-one
(2S)-2β,3α-ジフェニル-5α-メトキシ-2,3,6,6aα,7,10aα-ヘキサヒドロ-5H-1,4-ベンゾジオキソシン-8-オン
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
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
Molecular formula： C23H24O4
Molecular formula furigana： C23-H24-O4
Molecular weight： 364.441
InChI：
InChI=1S/C23H24O4/c1-25-21-15-18-14-19(24)12-13-20(18)26-22(16-8-4-2-5-9-16)23(27-21)17-10-6-3-7-11-17/h2-13,18,20-23H,14-15H2,1H3/t18-,20-,21+,22+,23+/m1/s1
InChI key：
KVWWHAMAKWNCBJ-HMWDHGCWSA-N
SMILES：
CO[C@@H]1C[C@H]2CC(=O)C=C[C@H]2O[C@H]([C@@H](O1)c1ccccc1)c1ccccc1
Systematic name (4)：
- (2S)-2β,3α-ジフェニル-5α-メトキシ-2,3,6,6aα,7,10aα-ヘキサヒドロ-5H-1,4-ベンゾジオキソシン-8-オン
- (2S)-2β,3α-ジフェニル-5α-メトキシ-2,3,5,6,6aα,7,8,10aα-オクタヒドロ-1,4-ベンゾジオキソシン-8-オン
- (2S,3S,5S,6aS,10aS)-5-メトキシ-2,3-ジフェニル-2,3,5,6,6a,7,8,10a-オクタヒドロ-1,4-ベンゾジオキソシン-8-オン
- (2S,3S,5S,6aS,10aS)-5-methoxy-2,3-diphenyl-2,3,5,6,6a,7,8,10a-octahydro-1,4-benzodioxocin-8-one
- (2S)-2β,3α-Diphenyl-5α-methoxy-2,3,6,6aα,7,10aα-hexahydro-5H-1,4-benzodioxocin-8-one
- (2S)-2β,3α-Diphenyl-5α-methoxy-2,3,5,6,6aα,7,8,10aα-octahydro-1,4-benzodioxocin-8-one
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