Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:07:04 UTC
Update Date2025-03-25 00:34:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02078835
Frequency0.6
Structure
Chemical FormulaC5H7NO2
Molecular Mass113.0477
SMILESCCNC(O)=C=C=O
InChI KeyGGUMLCCJSKKMTG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent alkanolamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • secondary amine
  • organic oxide
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound
  • alkanolamine