Chem
J-GLOBAL ID：200907038230880449   Nikkaji number：J2.201.831K

(20S)-6β,15β,17α,20-Tetrahydroxy-2-oxapregna-4-ene-3-one

(20S)-6β,15β,17α,20-テトラヒドロキシ-2-オキサプレグナ-4-エン-3-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： C20H30O6
Molecular formula furigana： C20-H30-O6
Molecular weight： 366.454
InChI： InChI=1S/C20H30O6/c1-10(21)20(25)8-15(23)17-11-6-14(22)13-7-16(24)26-9-18(13,2)12(11)4-5-19(17,20)3/h7,10-12,14-15,17,21-23,25H,4-6,8-9H2,1-3H3/t10-,11+,12-,14+,15+,17+,18+,19-,20-/m0/s1
InChI key： WUOQGMQCUCOIIL-FVWWHDLQSA-N
SMILES： C[C@H](O)[C@@]1(O)C[C@@H](O)[C@H]2[C@@H]3C[C@@H](O)C4=CC(=O)OC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • (20S)-6β,15β,17α,20-テトラヒドロキシ-2-オキサプレグナ-4-エン-3-オン
  • (4aR,4bS,6aS,7R,9R,9aS,9bR,11R)-7,9,11-トリヒドロキシ-7-[(1S)-1-ヒドロキシエチル]-4a,6a-ジメチル-2H,4H,4aH,4bH,5H,6H,6aH,7H,8H,9H,9aH,9bH,10H,11H-インデノ[4,5-h]イソクロメン-2-オン
  • (4aR,4bS,6aS,7R,9R,9aS,9bR,11R)-7,9,11-trihydroxy-7-[(1S)-1-hydroxyethyl]-4a,6a-dimethyl-2H,4H,4aH,4bH,5H,6H,6aH,7H,8H,9H,9aH,9bH,10H,11H-indeno[4,5-h]isochromen-2-one
Other name (1)：
  • (20S)-6β,15β,17α,20-Tetrahydroxy-2-oxapregna-4-ene-3-one
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