Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:42:04 UTC
Update Date2025-03-21 17:59:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00019941
Frequency204.1
Structure
Chemical FormulaC9H14NO+
Molecular Mass152.107
SMILESC[N+](C)(C)c1ccc(O)cc1
InChI KeyFXKOEYONRSTWCP-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass aniline and substituted anilines
Direct Parent aniline and substituted anilines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • amines
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organooxygen compounds
  • organopnictogen compounds
  • quaternary ammonium salts
  • p-aminophenols
  • Substituents
  • aniline or substituted anilines
  • quaternary ammonium salt
  • aminophenol
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • p-aminophenol
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine
  • organooxygen compound