Chem
J-GLOBAL ID：200907060649899161   Nikkaji number：J1.761.680C

(3aα,6aα)-1-(1-Methylpyridinium-3-ylcarbonyl)-6-phenyloctahydrocyclopenta[b]pyrrole-6β-ol

(3aα,6aα)-1-(1-メチルピリジニウム-3-イルカルボニル)-6-フェニルオクタヒドロシクロペンタ[b]ピロール-6β-オール
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： C20H23N[N+]O2
Molecular formula furigana： C20-H23-N2-O2
Molecular weight： 323.415
InChI： InChI=1S/C20H23N2O2/c1-21-12-5-6-16(14-21)19(23)22-13-10-15-9-11-20(24,18(15)22)17-7-3-2-4-8-17/h2-8,12,14-15,18,24H,9-11,13H2,1H3/q+1/t15-,18+,20+/m1/s1
InChI key： CYZYTCOEXOGICD-BPAFIMBUSA-N
SMILES： C[n+]1cccc(c1)C(=O)N1CC[C@H]2CC[C@@](O)([C@@H]12)c1ccccc1
Systematic name  (3)：
  • (3aα,6aα)-1-(1-メチルピリジニウム-3-イルカルボニル)-6-フェニルオクタヒドロシクロペンタ[b]ピロール-6β-オール
  • 3-[(3aR,6S,6aS)-6-ヒドロキシ-6-フェニル-オクタヒドロシクロペンタ[b]ピロール-1-カルボニル]-1-メチルピリジン-1-イウム
  • 3-[(3aR,6S,6aS)-6-hydroxy-6-phenyl-octahydrocyclopenta[b]pyrrole-1-carbonyl]-1-methylpyridin-1-ium
Other name (1)：
  • (3aα,6aα)-1-(1-Methylpyridinium-3-ylcarbonyl)-6-phenyloctahydrocyclopenta[b]pyrrole-6β-ol
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