Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:13:09 UTC
Update Date2025-03-24 22:38:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01235564
Frequency1.1
Structure
Chemical FormulaC4H4N4O2
Molecular Mass140.0334
SMILESNc1nc2[nH]oc(=O)c2[nH]1
InChI KeyIUDQNDRQBYRKII-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass isoxazoles
Direct Parent isoxazoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • isoxazole
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound