Chem
J-GLOBAL ID：200907011291002856   Nikkaji number：J2.201.832I

6-Chloro-15β,21-dihydroxy-17α-acetoxy-2-oxapregna-4,6-diene-3,20-dione

6-クロロ-15β,21-ジヒドロキシ-17α-アセトキシ-2-オキサプレグナ-4,6-ジエン-3,20-ジオン
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： C22H27ClO7
Molecular formula furigana： C22-H27-CL-O7
Molecular weight： 438.900
InChI： InChI=1S/C22H27ClO7/c1-11(25)30-22(17(27)9-24)8-16(26)19-12-6-15(23)14-7-18(28)29-10-20(14,2)13(12)4-5-21(19,22)3/h6-7,12-13,16,19,24,26H,4-5,8-10H2,1-3H3/t12-,13+,16-,19-,20-,21+,22+/m1/s1
InChI key： RLYMBMALMMMZJW-KXPZGRSSSA-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)CO
Systematic name  (3)：
  • 6-クロロ-15β,21-ジヒドロキシ-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)-11-クロロ-9-ヒドロキシ-7-(2-ヒドロキシアセチル)-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)-11-chloro-9-hydroxy-7-(2-hydroxyacetyl)-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 (1)：
  • 6-Chloro-15β,21-dihydroxy-17α-acetoxy-2-oxapregna-4,6-diene-3,20-dione
Thsaurus map：
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