Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:46:53 UTC
Update Date2025-03-21 18:01:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00031046
Frequency119.2
Structure
Chemical FormulaC15H19N3O
Molecular Mass257.1528
SMILESNC(Cc1c[nH]c2ccccc12)C(=O)N1CCCC1
InChI KeyJBIVCFFCONEPDR-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 heteropolycyclic compounds
Alternative Parents
  • alpha amino acids
  • azacyclic compounds
  • benzenoids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • monoalkylamines
  • n-acylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • tertiary carboxylic acid amides
  • Substituents
  • carbonyl group
  • indole
  • n-acylpyrrolidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • alpha-amino acid amide
  • azacycle
  • heteroaromatic compound
  • indole or derivatives
  • carboxamide group
  • organic oxygen compound
  • pyrrole
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound