Chem
J-GLOBAL ID：200907004939813670   Nikkaji number：J1.129.566E

(3aβ,4S)-4β-(Phenylsulfonyl)-7aα-methylhydrindane-1-one

(3aβ,4S)-4β-(フェニルスルホニル)-7aα-メチルヒドリンダン-1-オン
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： C16H20O3S
Molecular formula furigana： C16-H20-O3-S
Molecular weight： 292.390
InChI： InChI=1S/C16H20O3S/c1-16-11-5-8-14(13(16)9-10-15(16)17)20(18,19)12-6-3-2-4-7-12/h2-4,6-7,13-14H,5,8-11H2,1H3/t13-,14+,16-/m1/s1
InChI key： VFMUWARKRABSIW-IJEWVQPXSA-N
SMILES： C[C@@]12CCC[C@@H]([C@H]1CCC2=O)S(=O)(=O)c1ccccc1
Systematic name  (4)：
  • (3aS,3aβ)-オクタヒドロ-4β-(フェニルスルホニル)-7aα-メチル-1H-インデン-1-オン
  • (3aβ,4S)-4β-(フェニルスルホニル)-7aα-メチルヒドリンダン-1-オン
  • (3aS,4S,7aR)-4-(ベンゼンスルホニル)-7a-メチル-オクタヒドロ-1H-インデン-1-オン
  • (3aS,4S,7aR)-4-(benzenesulfonyl)-7a-methyl-octahydro-1H-inden-1-one
Other name (2)：
  • (3aS,3aβ)-Octahydro-4β-(phenylsulfonyl)-7aα-methyl-1H-indene-1-one
  • (3aβ,4S)-4β-(Phenylsulfonyl)-7aα-methylhydrindane-1-one
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