Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:29:33 UTC
Update Date2025-03-21 20:57:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00413049
Frequency4.4
Structure
Chemical FormulaC5H8N4O
Molecular Mass140.0698
SMILESNc1cc(N)c(N)c(=O)[nH]1
InChI KeyCERKBNWVICMUNB-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
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyridines and derivatives
  • pyridinones
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • 2-halopyridine
  • organic nitrogen compound
  • pyridinone
  • amine
  • organooxygen compound