Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-21 00:16:42 UTC
Update Date2025-03-21 18:34:44 UTC
HMDB IDHMDB0015644
Metabolite Identification
DeepMet IDDMID00102236
NameBetahistine
Frequency26.6
Structure
Chemical FormulaC8H12N2
Molecular Mass136.1
SMILESCNCCc1ccccn1
InChI KeyUUQMNUMQCIQDMZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass methylpyridines
Direct Parent methylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • methylpyridine
  • secondary amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • amine