Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:22 UTC
Update Date2025-03-21 18:38:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123199
Frequency20.9
Structure
Chemical FormulaC16H20N2O
Molecular Mass256.1576
SMILESCCN(CC)CC(=O)Nc1cccc2ccccc12
InChI KeyDHPIEQRATJYNJL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-arylamides
  • naphthalenes
  • organic oxides
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • trialkylamines
  • Substituents
  • carbonyl group
  • alpha-amino acid amide
  • tertiary aliphatic amine
  • n-arylamide
  • aromatic homopolycyclic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxide
  • naphthalene
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound