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Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:42:11 UTC
Update Date2025-03-21 17:59:19 UTC
HMDB IDHMDB0240706
Metabolite Identification
DeepMet IDDMID00020182
NameEthylparaben sufate
Frequency201.1
Structure
Chemical FormulaC9H10O6S
Molecular Mass246.0198
SMILESCCOC(=O)c1ccc(OS(=O)(=O)O)cc1
InChI KeyLJXYMXIWXRFOHR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfuric acids and derivatives
Subclass arylsulfates
Direct Parent phenylsulfates
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzoic acid esters
  • benzoyl derivatives
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • phenoxy compounds
  • sulfuric acid monoesters
  • Substituents
  • monocyclic benzene moiety
  • sulfuric acid monoester
  • benzoyl
  • benzoic acid or derivatives
  • benzoate ester
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • phenylsulfate
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • sulfate-ester
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • sulfuric acid ester
  • organooxygen compound