Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:05:30 UTC
Update Date2025-03-24 22:29:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01216403
Frequency1.1
Structure
Chemical FormulaC6H13N3O
Molecular Mass143.1059
SMILESN=CNC(=O)CCCCN
InChI KeyXFQGVPLLOCMXCA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent delta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • imines
  • monoalkylamines
  • n-acyl amines
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • imine
  • carboximidamide
  • n-acyl-amine
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • delta amino acid or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound