Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:33 UTC
Update Date2025-03-21 18:37:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00116508
Frequency22.5
Structure
Chemical FormulaC13H17NO2
Molecular Mass219.1259
SMILESO=C(Cc1ccccc1)N1CCC(O)CC1
InChI KeyVUGHKZKJOXICON-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-acylpiperidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • tertiary carboxylic acid amides
  • Substituents
  • alcohol
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • n-acyl-piperidine
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • phenylacetamide
  • organoheterocyclic compound
  • organooxygen compound