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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:21 UTC
Update Date2025-03-25 00:46:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156574
Frequency0.5
Structure
Chemical FormulaC14H15NO2
Molecular Mass229.1103
SMILESO=C1CCC(=O)N1C1CCCc2ccccc21
InChI KeyPCVQELZRKFYAIH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dicarboximides
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • n-substituted carboxylic acid imides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine-2-ones
    • Substituents
  • 2-pyrrolidone
  • tetralin
  • carbonyl group
  • azacycle
  • n-alkylpyrrolidine
  • carboxylic acid derivative
  • carboxylic acid imide
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • dicarboximide
  • organic nitrogen compound
  • pyrrolidine
  • carboxylic acid imide, n-substituted
  • pyrrolidone
  • organoheterocyclic compound
  • organooxygen compound