Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:14:15 UTC
Update Date2025-03-24 21:05:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01668221
Frequency0.7
Structure
Chemical FormulaC6H11N2O+
Molecular Mass127.0866
SMILESC[N+]1=C(C(N)=O)CCC1
InChI KeyYJLZBWUOMUKRKD-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass alpha-imino acid and derivatives
Direct Parent alpha-imino acid and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • pyrrolines
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • azacycle
  • alpha-imino acid or derivatives
  • carboxamide group
  • organic oxide
  • pyrroline
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organoheterocyclic compound
  • organooxygen compound