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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:20 UTC
Update Date2025-03-21 18:36:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00111167
Frequency23.9
Structure
Chemical FormulaC8H8N2O4S
Molecular Mass228.0205
SMILESO=S(=O)(O)OC1=Nc2ccccc2NC1
InChI KeyAWXYORJOIBSMGU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazanaphthalenes
Subclass benzodiazines
Direct Parent quinoxalines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • diazanaphthalenes
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alkylarylamines
  • sulfuric acid monoesters
    • Substituents
  • quinoxaline
  • sulfuric acid monoester
  • organic sulfuric acid or derivatives
  • azacycle
  • organic 1,3-dipolar compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • sulfuric acid ester
  • amine
  • organooxygen compound