Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:25:34 UTC
Update Date2025-03-24 22:04:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01980030
Frequency0.6
Structure
Chemical FormulaC5H9NO
Molecular Mass99.0684
SMILESOC1CC=CCN1
InChI KeyMGRCCNWADHAPCD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent hemiaminals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • hemiaminal
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound