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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:54 UTC
Update Date2025-03-25 00:52:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194119
Frequency0.5
Structure
Chemical FormulaC10H13N3O4S
Molecular Mass271.0627
SMILESCN=C(NC)NS(=O)(=O)c1ccc(C(=O)O)cc1
InChI KeyJMADEVNFWWMXOC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzenesulfonamides
Direct Parent benzenesulfonamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aminosulfonyl compounds
  • benzenesulfonyl compounds
  • benzoic acids
  • benzoyl derivatives
  • carboximidamides
  • carboxylic acids
  • guanidines
  • hydrocarbon derivatives
  • imines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfonic acids and derivatives
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • organosulfonic acid or derivatives
  • carboxylic acid
  • guanidine
  • imine
  • benzoyl
  • organosulfur compound
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • benzoic acid
  • benzenesulfonyl group
  • benzenesulfonamide
  • aminosulfonyl compound
  • benzoic acid or derivatives
  • organic 1,3-dipolar compound
  • carboximidamide
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound