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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:03:11 UTC
Update Date2025-03-24 20:35:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01497142
Frequency0.9
Structure
Chemical FormulaC4H5N3O3
Molecular Mass143.0331
SMILESO=C(O)C1=NNN=C(O)C1
InChI KeyNBMPYBJDJCRIDY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass 1,2,3-triazines
Direct Parent 1,2,3-triazines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • 1,2,3-triazine
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound