Chem
J-GLOBAL ID：201507054864438946   Nikkaji number：J3.361.837I

N-[(8S,9S)-Cinchonan-9-yl]-L-leucinamide

N-[(8S,9S)-シンコナン-9-イル]-L-ロイシンアミド
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： C25H34N4O
Molecular formula furigana： C25-H34-N4-O
Molecular weight： 406.574
InChI： InChI=1S/C25H34N4O/c1-4-17-15-29-12-10-18(17)14-23(29)24(28-25(30)21(26)13-16(2)3)20-9-11-27-22-8-6-5-7-19(20)22/h4-9,11,16-18,21,23-24H,1,10,12-15,26H2,2-3H3,(H,28,30)/t17-,18-,21-,23-,24-/m0/s1
InChI key： MEQYNGYAOVNQGI-NZKJHGSESA-N
SMILES： CC(C)C[C@H](N)C(=O)N[C@H]([C@@H]1C[C@@H]2CCN1C[C@@H]2C=C)c1ccnc2ccccc12
Systematic name  (3)：
  • N-[(8S,9S)-シンコナン-9-イル]-L-ロイシンアミド
  • (2S)-2-アミノ-N-[(S)-[(2S,4S,5R)-5-エテニル-1-アザビシクロ[2.2.2]オクタン-2-イル](キノリン-4-イル)メチル]-4-メチルペンタンアミド
  • (2S)-2-amino-N-[(S)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methyl]-4-methylpentanamide
Other name (1)：
  • N-[(8S,9S)-Cinchonan-9-yl]-L-leucinamide
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