Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:52:36 UTC
Update Date2025-03-24 22:24:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01184261
Frequency1.1
Structure
Chemical FormulaC7H10N2O
Molecular Mass138.0793
SMILESCC(O)c1ccc(N)nc1
InChI KeyLFMPKMMDRCQTGT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • imidolactams
  • methylpyridines
  • organopnictogen compounds
  • primary amines
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • 2-halopyridine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound