Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:40:57 UTC
Update Date2025-03-24 17:55:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01012703
Frequency1.4
Structure
Chemical FormulaC4H3N3O3
Molecular Mass141.0174
SMILESO=c1[nH]c2o[nH]c(=O)c2[nH]1
InChI KeyMJARDHQICOKPEH-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
  • lactams
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonic acid derivative
  • lactam
  • azacycle
  • heteroaromatic compound
  • isoxazole
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound