Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:12 UTC
Update Date2025-03-21 17:57:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00011296
Frequency410.2
Structure
Chemical FormulaC7H9NO
Molecular Mass123.0684
SMILESCc1ccc(CO)cn1
InChI KeyDJCJOWDAAZEMCI-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
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound