Chem
J-GLOBAL ID：200907017727937927   Nikkaji number：J2.201.830B

6β,17α,21-Trihydroxy-2-oxapregna-4-ene-3,20-dione

6β,17α,21-トリヒドロキシ-2-オキサプレグナ-4-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： C20H28O6
Molecular formula furigana： C20-H28-O6
Molecular weight： 364.438
InChI： InChI=1S/C20H28O6/c1-18-10-26-17(24)8-14(18)15(22)7-11-12(18)3-5-19(2)13(11)4-6-20(19,25)16(23)9-21/h8,11-13,15,21-22,25H,3-7,9-10H2,1-2H3/t11-,12+,13+,15-,18-,19+,20+/m1/s1
InChI key： VBEMOXKHRGQJIE-MNPQAXFZSA-N
SMILES： C[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)OC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
Systematic name  (3)：
  • 6β,17α,21-トリヒドロキシ-2-オキサプレグナ-4-エン-3,20-ジオン
  • (4aR,4bS,6aS,7R,9aS,9bR,11R)-7,11-ジヒドロキシ-7-(2-ヒドロキシアセチル)-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,9aS,9bR,11R)-7,11-dihydroxy-7-(2-hydroxyacetyl)-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)：
  • 6β,17α,21-Trihydroxy-2-oxapregna-4-ene-3,20-dione
Thsaurus map：
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