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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:33:46 UTC
Update Date2025-03-21 17:56:22 UTC
HMDB IDHMDB0125166
Metabolite Identification
DeepMet IDDMID00000906
Namep-Coumaric acid sulfate
Frequency6245.5
Structure
Chemical FormulaC9H8O6S
Molecular Mass244.0042
SMILESO=C(O)C=Cc1ccc(OS(=O)(=O)O)cc1
InChI KeyOYDCCWNLILCHDJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcinnamic acids and derivatives
Subclass cinnamic acids and derivatives
Direct Parent cinnamic acids and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • phenoxy compounds
  • phenylsulfates
  • sulfuric acid monoesters
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • sulfuric acid monoester
  • carboxylic acid
  • organic sulfuric acid or derivatives
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • phenylsulfate
  • cinnamic acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • sulfate-ester
  • hydrocarbon derivative
  • arylsulfate
  • benzenoid
  • phenoxy compound
  • sulfuric acid ester
  • organooxygen compound