Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:06:51 UTC
Update Date2025-03-21 23:07:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00643474
Frequency2.5
Structure
Chemical FormulaC5H7N3O
Molecular Mass125.0589
SMILESNc1ccnc(CO)n1
InChI KeyXSUMVOZBKJPGII-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidines and pyrimidine derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organopnictogen compounds
  • primary amines
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • pyrimidine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound