Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:01 UTC
Update Date2025-03-25 00:50:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02183105
Frequency0.5
Structure
Chemical FormulaC4H6NO+
Molecular Mass84.0444
SMILESO=[N+]1C=CCC1
InChI KeyZQVHFMJBFJHFNA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • aminoxides
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic oxoazanium compounds
  • organopnictogen compounds
  • Substituents
  • azacycle
  • organic oxide
  • organic oxygen compound
  • pyrroline
  • aminoxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic oxoazanium