Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:43 UTC
Update Date2025-03-21 18:34:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00102283
Frequency26.6
Structure
Chemical FormulaC6H9N3O
Molecular Mass139.0746
SMILESNCCc1cc(O)ncn1
InChI KeyHEPRVCDWOMKUHJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent hydroxypyrimidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyrimidine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound