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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:49 UTC
Update Date2025-03-25 00:48:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02166663
Frequency0.5
Structure
Chemical FormulaC16H18N2O3
Molecular Mass286.1317
SMILESCC(=O)NCCC(O)C(=O)Nc1cccc2ccccc12
InChI KeyYKLCSNWIXLTMBZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • acetamides
  • carbonyl compounds
  • carboxylic acids and derivatives
  • fatty amides
  • hydrocarbon derivatives
  • monosaccharides
  • n-arylamides
  • naphthalenes
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • alcohol
  • fatty acyl
  • carbonyl group
  • gamma amino acid or derivatives
  • fatty amide
  • monosaccharide
  • n-arylamide
  • aromatic homopolycyclic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • saccharide
  • organic oxide
  • naphthalene
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • acetamide
  • organooxygen compound