Chem
J-GLOBAL ID：200907040081350789
Nikkaji number：J2.752.655A
(2S)-3aβ-(Cyclohexyloxy)-8-(phenylsulfonyl)-1,2,3,3a-tetrahydrocyclopenta[a]indene-2α,3α-diol
(2S)-3aβ-(シクロヘキシルオキシ)-8-(フェニルスルホニル)-1,2,3,3a-テトラヒドロシクロペンタ[a]インデン-2α,3α-ジオール
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： C24H26O5S
Molecular formula furigana： C24-H26-O5-S
Molecular weight： 426.530
InChI：
InChI=1S/C24H26O5S/c25-21-15-20-22(30(27,28)17-11-5-2-6-12-17)18-13-7-8-14-19(18)24(20,23(21)26)29-16-9-3-1-4-10-16/h2,5-8,11-14,16,21,23,25-26H,1,3-4,9-10,15H2/t21-,23-,24-/m0/s1
InChI key：
GSMWHWWRLSWAQR-XWGVYQGASA-N
SMILES：
O[C@H]1CC2=C(c3ccccc3[C@@]2(OC2CCCCC2)[C@H]1O)S(=O)(=O)c1ccccc1
Systematic name (3)：
- (2S)-3aβ-(シクロヘキシルオキシ)-8-(フェニルスルホニル)-1,2,3,3a-テトラヒドロシクロペンタ[a]インデン-2α,3α-ジオール
- (2S,3S,3aS)-8-(ベンゼンスルホニル)-3a-(シクロヘキシルオキシ)-1H,2H,3H,3aH-シクロペンタ[a]インデン-2,3-ジオール
- (2S,3S,3aS)-8-(benzenesulfonyl)-3a-(cyclohexyloxy)-1H,2H,3H,3aH-cyclopenta[a]indene-2,3-diol
- (2S)-3aβ-(Cyclohexyloxy)-8-(phenylsulfonyl)-1,2,3,3a-tetrahydrocyclopenta[a]indene-2α,3α-diol
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