Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:44 UTC
Update Date2025-03-25 00:59:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02234983
Frequency0.5
Structure
Chemical FormulaC8H13N3O2
Molecular Mass183.1008
SMILESCc1nc(N)c(CN)c(CO)c1O
InChI KeyIQKHTBDFAWUANT-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
  • imidolactams
  • monoalkylamines
  • 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
  • primary amine
  • 2-halopyridine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound