Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:01:49 UTC
Update Date2025-03-24 16:37:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00918658
Frequency1.6
Structure
Chemical FormulaC6H12NO+
Molecular Mass114.0913
SMILESCC=C[N+](=O)CCC
InChI KeyROFKDZXBBSEHAJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganic oxoazanium compounds
Subclass organic oxoazanium compounds
Direct Parent organic oxoazanium compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aminoxides
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • aminoxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic oxoazanium