Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:17:44 UTC
Update Date2025-03-24 21:34:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01820060
Frequency0.7
Structure
Chemical FormulaC5H8N2O
Molecular Mass112.0637
SMILESNc1ccc(CO)[nH]1
InChI KeyJLVSEPPMFWXVRR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • pyrroles
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound