Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:55 UTC
Update Date2025-03-21 18:39:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124435
Frequency20.7
Structure
Chemical FormulaC10H11NO
Molecular Mass161.0841
SMILESCN1CCC(=O)c2ccccc21
InChI KeyPFRCTAQFFQYTKL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass quinolones and derivatives
Direct Parent hydroquinolones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aryl alkyl ketones
  • azacyclic compounds
  • benzenoids
  • dialkylarylamines
  • hydrocarbon derivatives
  • hydroquinolines
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • tetrahydroquinolone
  • aryl alkyl ketone
  • azacycle
  • ketone
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • dialkylarylamine
  • tetrahydroquinoline
  • amine
  • tertiary amine
  • organooxygen compound
  • aryl ketone