Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:38:02 UTC
Update Date2025-03-24 20:50:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01581815
Frequency0.8
Structure
Chemical FormulaC8H9NO
Molecular Mass135.0684
SMILESOc1cncc(C2CC2)c1
InChI KeyWMZKEKVRZYIBDX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound