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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:23 UTC
Update Date2025-03-25 00:58:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02234164
Frequency0.5
Structure
Chemical FormulaC5H5NO5S
Molecular Mass190.9888
SMILESO=c1c(O)c[nH]cc1S(=O)(=O)O
InChI KeyREOFWWRDUZLJHS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfonic acids and derivatives
Subclass organosulfonic acids and derivatives
Direct Parent arylsulfonic acids and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • cyclic ketones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfonic acids
  • polyhalopyridines
  • sulfonyls
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • organosulfonic acid
  • hydroxypyridine
  • cyclic ketone
  • organosulfur compound
  • organic oxide
  • sulfonyl
  • pyridine
  • arylsulfonic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound