Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:29:51 UTC
Update Date2025-03-24 21:39:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01848250
Frequency0.7
Structure
Chemical FormulaC5H7N3O
Molecular Mass125.0589
SMILESCn1cc(N)c(=O)cn1
InChI KeyIAEMDJITWPEJKO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyridazines and derivatives
Direct Parent pyridazines and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • cyclic ketones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • cyclic ketone
  • organic oxide
  • organic oxygen compound
  • pyridazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound