Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:31:57 UTC
Update Date2025-03-24 17:51:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00991177
Frequency1.4
Structure
Chemical FormulaC5H8N2O
Molecular Mass112.0637
SMILESNCc1[nH]ccc1O
InChI KeyPLGKRHPOAYVZCM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound