Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:28:46 UTC
Update Date2025-03-24 20:20:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01416189
Frequency0.9
Structure
Chemical FormulaC6H12NO+
Molecular Mass114.0913
SMILESCC(=O)C(C)=[N+](C)C
InChI KeyQJMOONHOCZRFMJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass imines
Direct Parent secondary ketimines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketones
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • ketone
  • secondary ketimine
  • organic oxide
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organooxygen compound