Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:21 UTC
Update Date2025-03-21 17:58:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00013980
Frequency317.1
Structure
Chemical FormulaC7H10N2O2
Molecular Mass154.0742
SMILESNCc1c(O)cncc1CO
InChI KeyQZDXMPNQCNZCCD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monoalkylamines
  • 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
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound