Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:53:04 UTC
Update Date2025-03-21 18:52:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00188441
Frequency12.1
Structure
Chemical FormulaC7H14NO2+
Molecular Mass144.1019
SMILESC[N+](C)(C)CC(=O)CC=O
InChI KeyWKZNJGIUNIPYKU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta ketoaldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-amino ketones
  • alpha-hydrogen aldehydes
  • amines
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • beta-ketoaldehyde
  • ketone
  • organic oxide
  • alpha-aminoketone
  • alpha-hydrogen aldehyde
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine