Chem
J-GLOBAL ID:200907017988110000   Nikkaji number:J724.206I

Acetic acid [(4aα)-1β-isopropoxy-6-methylene-7aα-(phenylsulfonyl)octahydrocyclopenta[c]pyran]-4α-yl ester

酢酸[(4aα)-1β-イソプロポキシ-6-メチレン-7aα-(フェニルスルホニル)オクタヒドロシクロペンタ[c]ピラン]-4α-イル
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: C20H26O6S
Molecular formula furigana: C20-H26-O6-S
Molecular weight: 394.480
InChI: InChI=1S/C20H26O6S/c1-13(2)25-19-20(27(22,23)16-8-6-5-7-9-16)11-14(3)10-17(20)18(12-24-19)26-15(4)21/h5-9,13,17-19H,3,10-12H2,1-2,4H3/t17-,18+,19-,20+/m1/s1
InChI key: WSJDJRCDPKNYEZ-WCIQWLHISA-N
SMILES: CC(C)O[C@H]1OC[C@H](OC(=O)C)[C@H]2CC(=C)C[C@@]12S(=O)(=O)c1ccccc1
Systematic name  (3):
  • 酢酸[(4aα)-1β-イソプロポキシ-6-メチレン-7aα-(フェニルスルホニル)オクタヒドロシクロペンタ[c]ピラン]-4α-イル
  • (1R,4R,4aR,7aS)-7a-(ベンゼンスルホニル)-6-メチリデン-1-(プロパン-2-イルオキシ)-オクタヒドロシクロペンタ[c]ピラン-4-イル アセタート
  • (1R,4R,4aR,7aS)-7a-(benzenesulfonyl)-6-methylidene-1-(propan-2-yloxy)-octahydrocyclopenta[c]pyran-4-yl acetate
Other name (1):
  • Acetic acid [(4aα)-1β-isopropoxy-6-methylene-7aα-(phenylsulfonyl)octahydrocyclopenta[c]pyran]-4α-yl ester
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