Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:14 UTC
Update Date2025-03-25 00:58:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02229288
Frequency0.5
Structure
Chemical FormulaC12H26NO3+
Molecular Mass232.1907
SMILESCCCCCCC(=O)OOCC[N+](C)(C)C
InChI KeyMWAUDNYHVRDFID-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass peroxycarboxylic acids and derivatives
Direct Parent peroxycarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amines
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • peroxycarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine
  • organooxygen compound