Chem
J-GLOBAL ID：200907045366732580   Nikkaji number：J2.612.346A

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

(3aS)-2-オキソ-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： C16H20N2O4
Molecular formula furigana： C16-H20-N2-O4
Molecular weight： 304.346
InChI： InChI=1S/C16H20N2O4/c1-22-16(21)9-4-5-13-10(7-9)15-11(8-14(20)18-15)12(17-13)3-2-6-19/h4-5,7,11-12,15,17,19H,2-3,6,8H2,1H3,(H,18,20)/t11-,12-,15+/m0/s1
InChI key： NCKZYIJQBWTENG-SLEUVZQESA-N
SMILES： COC(=O)c1ccc2N[C@@H](CCCO)[C@@H]3CC(=O)N[C@@H]3c2c1
Systematic name  (3)：
  • (3aS)-2-オキソ-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
  • メチル (3aS,4S,9bS)-4-(3-ヒドロキシプロピル)-2-オキソ-1H,2H,3H,3aH,4H,5H,9bH-ピロロ[3,2-c]キノリン-8-カルボキシラート
  • methyl (3aS,4S,9bS)-4-(3-hydroxypropyl)-2-oxo-1H,2H,3H,3aH,4H,5H,9bH-pyrrolo[3,2-c]quinoline-8-carboxylate
Other name (1)：
  • (3aS)-2-Oxo-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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