Chem
J-GLOBAL ID：200907065314149488   Nikkaji number：J1.495.784G

(4aR)-2,3,5,8,9-Pentamethyl-6-oxo-1,4,4a,5,6,6aα,7,10,10aβ,10bα-decahydrophenanthridine-4aα-carboxylic acid methyl ester

(4aR)-2,3,5,8,9-ペンタメチル-6-オキソ-1,4,4a,5,6,6aα,7,10,10aβ,10bα-デカヒドロフェナントリジン-4aα-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： C20H29NO3
Molecular formula furigana： C20-H29-N-O3
Molecular weight： 331.456
InChI： InChI=1S/C20H29NO3/c1-11-7-15-16(8-12(11)2)18(22)21(5)20(19(23)24-6)10-14(4)13(3)9-17(15)20/h15-17H,7-10H2,1-6H3/t15-,16-,17+,20+/m0/s1
InChI key： TYMGLISEKHHIQQ-MIALQEHNSA-N
SMILES： COC(=O)[C@@]12CC(=C(C)C[C@@H]1[C@H]1CC(=C(C)C[C@@H]1C(=O)N2C)C)C
Systematic name  (3)：
  • (4aR)-2,3,5,8,9-ペンタメチル-6-オキソ-1,4,4a,5,6,6aα,7,10,10aβ,10bα-デカヒドロフェナントリジン-4aα-カルボン酸メチル
  • メチル (4aR,6aS,10aR,10bR)-2,3,5,8,9-ペンタメチル-6-オキソ-1,4,4a,5,6,6a,7,10,10a,10b-デカヒドロフェナントリジン-4a-カルボキシラート
  • methyl (4aR,6aS,10aR,10bR)-2,3,5,8,9-pentamethyl-6-oxo-1,4,4a,5,6,6a,7,10,10a,10b-decahydrophenanthridine-4a-carboxylate
Other name (1)：
  • (4aR)-2,3,5,8,9-Pentamethyl-6-oxo-1,4,4a,5,6,6aα,7,10,10aβ,10bα-decahydrophenanthridine-4aα-carboxylic acid methyl ester
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