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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:07 UTC
Update Date2025-03-25 00:55:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213221
Frequency0.5
Structure
Chemical FormulaC13H16N2O2
Molecular Mass232.1212
SMILESCN1CC(=O)N(C)C(Cc2ccccc2)C1=O
InChI KeyXLGKKCPLZMCFQC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2,5-dioxopiperazines
  • azacyclic compounds
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • n-methylpiperazines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • lactam
  • aromatic heteromonocyclic compound
  • 2,5-dioxopiperazine
  • organic oxide
  • dioxopiperazine
  • piperazine
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • azacycle
  • n-alkylpiperazine
  • n-methylpiperazine
  • carboxamide group
  • organic oxygen compound
  • 1,4-diazinane
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound