Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:02:47 UTC
Update Date2025-03-24 14:10:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00777111
Frequency1.9
Structure
Chemical FormulaC7H11N2O+
Molecular Mass139.0866
SMILESC[n+]1cccc(C(N)O)c1
InChI KeyUVCRTLRBNPYIAE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyridinecarboxylic acids and derivatives
Direct Parent nicotinamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkanolamines
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monoalkylamines
  • n-methylpyridinium compounds
  • organic cations
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic alcohol
  • n-methylpyridinium
  • aromatic heteromonocyclic compound
  • azacycle
  • nicotinamide
  • heteroaromatic compound
  • hydroxypyridine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organic cation
  • organooxygen compound
  • alkanolamine