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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:36 UTC
Update Date2025-03-21 18:02:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00039960
Frequency86.7
Structure
Chemical FormulaC13H15NO
Molecular Mass201.1154
SMILESCNCC(O)c1ccc2ccccc2c1
InChI KeyPGJYKUWYKVJKJC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • aromatic alcohols
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
    • Substituents
  • aromatic alcohol
  • alcohol
  • secondary aliphatic amine
  • aromatic homopolycyclic compound
  • secondary amine
  • naphthalene
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine