Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:24:25 UTC
Update Date2025-03-21 20:54:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00400937
Frequency4.5
Structure
Chemical FormulaC7H6N2O
Molecular Mass134.048
SMILESOc1cnc2cc[nH]c2c1
InChI KeyYPBPBVINIWDVDK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound