Chem
J-GLOBAL ID:200907028740201656   Nikkaji number:J579.349A

17-Acetoxy-6-chloro-15β-hydroxy-2-oxapregna-4,6-diene-3,20-dione

17-アセトキシ-6-クロロ-15β-ヒドロキシ-2-オキサプレグナ-4,6-ジエン-3,20-ジオン
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: C22H27ClO6
Molecular formula furigana: C22-H27-CL-O6
Molecular weight: 422.900
InChI: InChI=1S/C22H27ClO6/c1-11(24)22(29-12(2)25)9-17(26)19-13-7-16(23)15-8-18(27)28-10-20(15,3)14(13)5-6-21(19,22)4/h7-8,13-14,17,19,26H,5-6,9-10H2,1-4H3/t13-,14+,17-,19-,20-,21+,22+/m1/s1
InChI key: PUVIUQNYQQPAQB-LZGXPLDUSA-N
SMILES: CC(=O)O[C@@]1(C[C@@H](O)[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)OC[C@]4(C)[C@H]3CC[C@]12C)C(=O)C
Systematic name  (5):
  • 17-アセトキシ-6-クロロ-15β-ヒドロキシ-2-オキサプレグナ-4,6-ジエン-3,20-ジオン
  • 17α-アセトキシ-6-クロロ-15β-ヒドロキシ-2-オキサプレグナ-4,6-ジエン-3,20-ジオン
  • 6-クロロ-15β-ヒドロキシ-17α-アセトキシ-2-オキサプレグナ-4,6-ジエン-3,20-ジオン
  • (4aR,4bS,6aS,7R,9R,9aS,9bR)-7-アセチル-11-クロロ-9-ヒドロキシ-4a,6a-ジメチル-2-オキソ-2H,4H,4aH,4bH,5H,6H,6aH,7H,8H,9H,9aH,9bH-インデノ[4,5-h]イソクロメン-7-イル アセタート
  • (4aR,4bS,6aS,7R,9R,9aS,9bR)-7-acetyl-11-chloro-9-hydroxy-4a,6a-dimethyl-2-oxo-2H,4H,4aH,4bH,5H,6H,6aH,7H,8H,9H,9aH,9bH-indeno[4,5-h]isochromen-7-yl acetate
Other name (3):
  • 17α-Acetoxy-6-chloro-15β-hydroxy-2-oxapregna-4,6-diene-3,20-dione
  • 17-Acetoxy-6-chloro-15β-hydroxy-2-oxapregna-4,6-diene-3,20-dione
  • 6-Chloro-15β-hydroxy-17α-acetoxy-2-oxapregna-4,6-diene-3,20-dione
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