Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:01 UTC
Update Date2025-03-25 00:49:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171618
Frequency0.5
Structure
Chemical FormulaC17H19NO
Molecular Mass253.1467
SMILESCN(CCCC(=O)c1ccccc1)c1ccccc1
InChI KeyFUVLNNSVBDYJHG-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
  • aniline and substituted anilines
  • aryl alkyl ketones
  • benzoyl derivatives
  • butyrophenones
  • dialkylarylamines
  • gamma-amino ketones
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • phenylbutylamines
  • Substituents
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • benzoyl
  • organic oxide
  • phenylbutylamine
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • tertiary amine
  • gamma-aminoketone
  • aniline or substituted anilines
  • butyrophenone
  • aromatic homomonocyclic compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • alkyl-phenylketone