Chem
J-GLOBAL ID：200907004200919624   Nikkaji number：J2.668.833G

Premalbrancheamide

プレマルブランケアミド
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： C21H25N3O
Molecular formula furigana： C21-H25-N3-O
Molecular weight： 335.451
InChI： InChI=1S/C21H25N3O/c1-19(2)16-11-21-8-5-9-24(21)12-20(16,23-18(21)25)10-14-13-6-3-4-7-15(13)22-17(14)19/h3-4,6-7,16,22H,5,8-12H2,1-2H3,(H,23,25)/t16-,20+,21-/m0/s1
InChI key： LBTZXCFDJFHPMI-DQLDELGASA-N
SMILES： CC1(C)[C@@H]2C[C@]34CCCN3C[C@@]2(Cc2c1[nH]c1ccccc21)NC4=O
Systematic name  (2)：
  • (3S,4aS,11aS)-2,3-プロパノ-5,5-ジメチル-11a,3-(エピミノメタノ)-2,3,4,4a,5,6,11,11a-オクタヒドロ-1H-ピリド[4,3-b]カルバゾール-13-オン
  • (3S)-5,5-ジメチル-2,3-プロパノ-11aα,3α-(エピミノメタノ)-2,3,4,4aα,5,6,11,11a-オクタヒドロ-1H-ピリド[4,3-b]カルバゾール-13-オン
Other name (6)：
  • (3S,4aS,11aS)-2,3-Propano-5,5-dimethyl-11a,3-(epiminomethano)-2,3,4,4a,5,6,11,11a-octahydro-1H-pyrido[4,3-b]carbazole-13-one
  • プレマルブランケアミド
  • Premalbrancheamide
  • (3S)-5,5-Dimethyl-2,3-propano-11aα,3α-(epiminomethano)-2,3,4,4aα,5,6,11,11a-octahydro-1H-pyrido[4,3-b]carbazole-13-one
  • (+)-プレマルブランケアミド
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