Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:42 UTC
Update Date2025-03-25 00:49:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02175518
Frequency0.5
Structure
Chemical FormulaC14H21NO
Molecular Mass219.1623
SMILESCCCCCCCC(=O)c1cccc(N)c1
InChI KeyCRNPPBKBGCIBRD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alkyl-phenylketones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl alkyl ketones
  • benzoyl derivatives
  • butyrophenones
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • Substituents
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • benzoyl
  • butyrophenone
  • aromatic homomonocyclic compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • amine
  • alkyl-phenylketone