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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:51 UTC
Update Date2025-03-25 00:57:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02224112
Frequency0.5
Structure
Chemical FormulaC15H14N2O6S
Molecular Mass350.0573
SMILESO=C(Cc1ccccc1)NC(=O)Nc1ccccc1OS(=O)(=O)O
InChI KeyAIIJAXSFDNFGPO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass n-phenylureas
Direct Parent n-acyl-phenylureas
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dicarboximides
  • hydrocarbon derivatives
  • n-acyl ureas
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • phenylacetamides
  • phenylsulfates
  • sulfuric acid monoesters
    • Substituents
  • sulfuric acid monoester
  • carbonyl group
  • carboxylic acid derivative
  • phenylsulfate
  • organic oxide
  • n-acyl-phenylurea
  • organonitrogen compound
  • organopnictogen compound
  • arylsulfate
  • dicarboximide
  • ureide
  • phenylacetamide
  • n-acyl urea
  • carbonic acid derivative
  • organic sulfuric acid or derivatives
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • sulfate-ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • sulfuric acid ester
  • organooxygen compound