Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:57 UTC
Update Date2025-03-25 00:59:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02239987
Frequency0.5
Structure
Chemical FormulaC13H25N3O
Molecular Mass239.1998
SMILESNCCCCC(N)C(=O)N1CC2CCCC2C1
InChI KeyGMDXRNCYECRVHH-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 aliphatic heteropolycyclic compounds
Alternative Parents
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • n-acylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
  • Substituents
  • carbonyl group
  • alpha-amino acid amide
  • azacycle
  • n-acylpyrrolidine
  • carboxamide group
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • organooxygen compound