Chem
J-GLOBAL ID：200907064677027655   Nikkaji number：J1.439.394C

(9β,10α,13α,14β)-4,4,8α-Trimethyl-17-oxo-D-homo-5β-androstane-17aα-carboxylic acid methyl ester

(9β,10α,13α,14β)-4,4,8α-トリメチル-17-オキソ-D-ホモ-5β-アンドロスタン-17aα-カルボン酸メチル
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： C25H40O3
Molecular formula furigana： C25-H40-O3
Molecular weight： 388.592
InChI： InChI=1S/C25H40O3/c1-22(2)12-7-13-23(3)17(22)10-14-24(4)18-9-8-16(26)20(21(27)28-6)25(18,5)15-11-19(23)24/h17-20H,7-15H2,1-6H3/t17-,18-,19+,20+,23-,24-,25-/m1/s1
InChI key： JYXSIVMRVGGRER-QRHIEUQNSA-N
SMILES： COC(=O)[C@@H]1C(=O)CC[C@@H]2[C@@]3(C)CC[C@@H]4C(C)(C)CCC[C@@]4(C)[C@@H]3CC[C@@]12C
Systematic name  (3)：
  • (9β,10α,13α,14β)-4,4,8α-トリメチル-17-オキソ-D-ホモ-5β-アンドロスタン-17aα-カルボン酸メチル
  • メチル (1S,4aR,4bS,6aR,10aR,10bS,12aR)-4b,7,7,10a,12a-ペンタメチル-2-オキソ-オクタデカヒドロクリセン-1-カルボキシラート
  • methyl (1S,4aR,4bS,6aR,10aR,10bS,12aR)-4b,7,7,10a,12a-pentamethyl-2-oxo-octadecahydrochrysene-1-carboxylate
Other name (1)：
  • (9β,10α,13α,14β)-4,4,8α-Trimethyl-17-oxo-D-homo-5β-androstane-17aα-carboxylic acid methyl ester
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