Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:58:57 UTC
Update Date2025-03-21 18:05:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00059688
Frequency52.6
Structure
Chemical FormulaC8H8N2O
Molecular Mass148.0637
SMILESOCc1c[nH]c2ncccc12
InChI KeyVWPSBHFXPGWHDI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyridines
Subclass pyrrolopyridines
Direct Parent pyrrolopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • organonitrogen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyrroles
  • Substituents
  • aromatic alcohol
  • alcohol
  • azacycle
  • pyrrolopyridine
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound