Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:46:10 UTC
Update Date2025-03-21 18:00:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00029398
Frequency127.1
Structure
Chemical FormulaC8H14NO+
Molecular Mass140.107
SMILESC[N+](C)(C)Cc1ccco1
InChI KeyHEDXEAAVEOJUCR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • tetraalkylammonium salts
  • Substituents
  • furan
  • tetraalkylammonium salt
  • aromatic heteromonocyclic compound
  • quaternary ammonium salt
  • heteroaromatic compound
  • aralkylamine
  • oxacycle
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • organoheterocyclic compound
  • organooxygen compound