Chem
J-GLOBAL ID：200907050571310896
Nikkaji number：J1.816.517A
3-(Phenylsulfonyl)-6α-methyl-4α,5α-epoxy-2-cyclohexene-1α-ol
3-(フェニルスルホニル)-6α-メチル-4α,5α-エポキシ-2-シクロヘキセン-1α-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： C13H14O4S
Molecular formula furigana： C13-H14-O4-S
Molecular weight： 266.310
InChI：
InChI=1S/C13H14O4S/c1-8-10(14)7-11(13-12(8)17-13)18(15,16)9-5-3-2-4-6-9/h2-8,10,12-14H,1H3/t8-,10-,12-,13+/m1/s1
InChI key：
YPLXMJQEXJZNQT-DXLKZPDWSA-N
SMILES：
C[C@H]1[C@H]2O[C@H]2C(=C[C@H]1O)S(=O)(=O)c1ccccc1
Systematic name (3)：
- 3-(フェニルスルホニル)-6α-メチル-4α,5α-エポキシ-2-シクロヘキセン-1α-オール
- (1R,2R,3S,6R)-5-(ベンゼンスルホニル)-2-メチル-7-オキサビシクロ[4.1.0]ヘプタ-4-エン-3-オール
- (1R,2R,3S,6R)-5-(benzenesulfonyl)-2-methyl-7-oxabicyclo[4.1.0]hept-4-en-3-ol
- 3-(Phenylsulfonyl)-6α-methyl-4α,5α-epoxy-2-cyclohexene-1α-ol
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