Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:50:35 UTC
Update Date2025-03-21 18:51:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00182662
Frequency12.6
Structure
Chemical FormulaC4H9NO
Molecular Mass87.0684
SMILESC=C[N+](C)(C)[O-]
InChI KeyVIVDKBXHJRBESW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent trisubstituted amine oxides and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organic oxoanionic compounds
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • trisubstituted n-oxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic hyponitrite