Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:55 UTC
Update Date2025-03-25 00:47:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162245
Frequency0.5
Structure
Chemical FormulaC17H20N2O4
Molecular Mass316.1423
SMILESO=C(O)CC1NC(=O)C2CCCN2C(=O)C1Cc1ccccc1
InChI KeyVTZFYIFISWRJNK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classpeptidomimetics
Subclass hybrid peptides
Direct Parent hybrid peptides
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,4-diazepanes
  • alpha amino acids
  • azacyclic compounds
  • benzene and substituted derivatives
  • beta amino acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • lactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidines
  • secondary carboxylic acid amides
  • tertiary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • lactam
  • carboxylic acid
  • 1,4-diazepane
  • diazepane
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • organic oxide
  • aromatic heteropolycyclic compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • azacycle
  • carboxamide group
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hybrid peptide
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound