Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:01:24 UTC
Update Date2025-03-21 18:06:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00065468
Frequency46.7
Structure
Chemical FormulaC21H46NO+
Molecular Mass328.3574
SMILESCCCCCCCCCCCCCCCCOCC[N+](C)(C)C
InChI KeyWCALYHQOFYRRTI-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
  • organic cations
  • organic salts
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • ether
  • tetraalkylammonium salt
  • dialkyl ether
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • amine
  • organooxygen compound