Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:55 UTC
Update Date2025-03-21 18:41:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00136150
Frequency18.4
Structure
Chemical FormulaC14H24NO+
Molecular Mass222.1852
SMILESC[N+](C)(C)CCCCC(O)c1ccccc1
InChI KeyJVAKJJZULCQULA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • amines
  • aromatic alcohols
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • secondary alcohols
  • tetraalkylammonium salts
  • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine
  • organooxygen compound