Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:55 UTC
Update Date2025-03-25 00:57:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02224262
Frequency0.5
Structure
Chemical FormulaC16H17NO2
Molecular Mass255.1259
SMILESO=C(C(O)c1ccc2ccccc2c1)N1CCCC1
InChI KeyRXCJVVHNICMWDU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-acylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • tertiary carboxylic acid amides
  • Substituents
  • aromatic alcohol
  • alcohol
  • carbonyl group
  • azacycle
  • n-acylpyrrolidine
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • organooxygen compound