Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:19:28 UTC
Update Date2025-03-24 20:00:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01104566
Frequency1.2
Structure
Chemical FormulaC8H9NO+
Molecular Mass135.0679
SMILESCC(=O)C1=CC=C[N+]=C1C
InChI KeyFZZRFJLSZYLSBZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass methylpyridines
Direct Parent methylpyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • ketimines
  • ketones
  • organic cations
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • ketimine
  • carbonyl group
  • azacycle
  • imine
  • methylpyridine
  • ketone
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound