Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:42:44 UTC
Update Date2025-03-25 01:32:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02438597
Frequency0.5
Structure
Chemical FormulaC7H14NO2+
Molecular Mass144.1019
SMILESCC(=O)OC=C[N+](C)(C)C
InChI KeyRRPWBKDWFUVVDU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass quaternary ammonium salts
Direct Parent quaternary ammonium salts
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amines
  • carbonyl compounds
  • enol esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • quaternary ammonium salt
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • enol ester
  • amine
  • organooxygen compound