Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:53 UTC
Update Date2025-03-25 00:53:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02198668
Frequency0.5
Structure
Chemical FormulaC12H17NO
Molecular Mass191.131
SMILESCCCNC(=O)Cc1ccccc1C
InChI KeyKGBNYVZFQOCENB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • toluenes
  • Substituents
  • carbonyl group
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • toluene
  • phenylacetamide
  • organooxygen compound