Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:38 UTC
Update Date2025-03-25 00:58:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230171
Frequency0.5
Structure
Chemical FormulaC12H26NO2+
Molecular Mass216.1958
SMILESCCCCCC(=O)COCC[N+](C)(C)C
InChI KeyUAJWUXZDBKORMZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass quaternary ammonium salts
Direct Parent tetraalkylammonium salts
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amines
  • dialkyl ethers
  • hydrocarbon derivatives
  • ketones
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • ether
  • tetraalkylammonium salt
  • dialkyl ether
  • ketone
  • organic oxide
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • amine
  • organooxygen compound