Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:52 UTC
Update Date2025-03-21 18:35:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105132
Frequency25.7
Structure
Chemical FormulaC16H17NO
Molecular Mass239.131
SMILESNC(Cc1ccccc1)C(=O)Cc1ccccc1
InChI KeyUSTQWSXTPXSCQL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslignans, neolignans and related compounds
ClassNot Available
Subclass lignans, neolignans and related compounds
Direct Parent lignans, neolignans and related compounds
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • amphetamines and derivatives
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • ketones
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • norlignan skeleton
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • amphetamine or derivatives