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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:53 UTC
Update Date2025-03-25 00:46:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153199
Frequency0.5
Structure
Chemical FormulaC15H19N3O3
Molecular Mass289.1426
SMILESNC(=O)CCC1CC(=O)NC(Cc2ccccc2)C(=O)N1
InChI KeyPNMYZBXXAQEJPR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classpeptidomimetics
Subclass hybrid peptides
Direct Parent hybrid peptides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,4-diazepanes
  • alpha amino acids
  • azacyclic compounds
  • benzene and substituted derivatives
  • beta amino acids and derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • fatty amides
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • secondary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • monocyclic benzene moiety
  • carbonyl group
  • lactam
  • 1,4-diazepane
  • aromatic heteromonocyclic compound
  • fatty amide
  • diazepane
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • azacycle
  • carboxamide group
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hybrid peptide
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound