Chem
J-GLOBAL ID：200907012774825515   Nikkaji number：J1.835.475F

(3aS)-1-(Benzyloxycarbonyl)-4α-(3-hydroxypropyl)-2,3,3aα,4,5,9bα-hexahydro-1H-pyrrolo[3,2-c]quinoline-8-carboxylic acid methyl ester

(3aS)-1-(ベンジルオキシカルボニル)-4α-(3-ヒドロキシプロピル)-2,3,3aα,4,5,9bα-ヘキサヒドロ-1H-ピロロ[3,2-c]キノリン-8-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： C24H28N2O5
Molecular formula furigana： C24-H28-N2-O5
Molecular weight： 424.497
InChI： InChI=1S/C24H28N2O5/c1-30-23(28)17-9-10-21-19(14-17)22-18(20(25-21)8-5-13-27)11-12-26(22)24(29)31-15-16-6-3-2-4-7-16/h2-4,6-7,9-10,14,18,20,22,25,27H,5,8,11-13,15H2,1H3/t18-,20-,22-/m0/s1
InChI key： UKSJPANEZBFNHC-VCOUNFBDSA-N
SMILES： COC(=O)c1ccc2N[C@@H](CCCO)[C@@H]3CCN([C@@H]3c2c1)C(=O)OCc1ccccc1
Systematic name  (3)：
  • (3aS)-1-(ベンジルオキシカルボニル)-4α-(3-ヒドロキシプロピル)-2,3,3aα,4,5,9bα-ヘキサヒドロ-1H-ピロロ[3,2-c]キノリン-8-カルボン酸メチル
  • 1-ベンジル 8-メチル (3aS,4S,9bS)-4-(3-ヒドロキシプロピル)-1H,2H,3H,3aH,4H,5H,9bH-ピロロ[3,2-c]キノリン-1,8-ジカルボキシラート
  • 1-benzyl 8-methyl (3aS,4S,9bS)-4-(3-hydroxypropyl)-1H,2H,3H,3aH,4H,5H,9bH-pyrrolo[3,2-c]quinoline-1,8-dicarboxylate
Other name (1)：
  • (3aS)-1-(Benzyloxycarbonyl)-4α-(3-hydroxypropyl)-2,3,3aα,4,5,9bα-hexahydro-1H-pyrrolo[3,2-c]quinoline-8-carboxylic acid methyl ester
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