Chem
J-GLOBAL ID：200907085098509904   Nikkaji number：J21.279B

9β-Fluoro-11β,17α-dihydroxy-6α-methyl-1,4-pregnadiene-3,20-dione

9β-フルオロ-11β,17α-ジヒドロキシ-6α-メチル-1,4-プレグナジエン-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： C22H29FO4
Molecular formula furigana： C22-H29-F-O4
Molecular weight： 376.468
InChI： InChI=1S/C22H29FO4/c1-12-9-17-15-6-8-21(27,13(2)24)20(15,4)11-18(26)22(17,23)19(3)7-5-14(25)10-16(12)19/h5,7,10,12,15,17-18,26-27H,6,8-9,11H2,1-4H3/t12-,15-,17-,18-,19-,20-,21-,22+/m0/s1
InChI key： FAOZLTXFLGPHNG-SJTSTTJWSA-N
SMILES： C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)C)[C@@]3(C)C[C@H](O)[C@@]2(F)[C@@]2(C)C=CC(=O)C=C12
Systematic name  (3)：
  • 9β-フルオロ-11β,17α-ジヒドロキシ-6α-メチル-1,4-プレグナジエン-3,20-ジオン
  • (1R,3aS,3bS,5S,9aS,9bS,10S,11aS)-1-アセチル-9b-フルオロ-1,10-ジヒドロキシ-5,9a,11a-トリメチル-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オン
  • (1R,3aS,3bS,5S,9aS,9bS,10S,11aS)-1-acetyl-9b-fluoro-1,10-dihydroxy-5,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (1)：
  • 9β-Fluoro-11β,17α-dihydroxy-6α-methyl-1,4-pregnadiene-3,20-dione
Regulation number (1)：
  • 7-(1)-355
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