Hmdb loader
Record Information
HMDB Statuspredicted
Creation Date2024-02-20 23:38:33 UTC
Update Date2025-03-21 17:58:05 UTC
HMDB IDHMDB0124988
Metabolite Identification
DeepMet IDDMID00012131
Name(3-ethenylphenyl)oxidanesulfonic acid
Frequency376.3
Structure
Chemical FormulaC8H8O4S
Molecular Mass200.0143
SMILESC=Cc1cccc(OS(=O)(=O)O)c1
InChI KeyMTJWPWXISDJJOR-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
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • phenoxy compounds
  • sulfuric acid monoesters
  • Substituents
  • monocyclic benzene moiety
  • sulfuric acid monoester
  • aromatic homomonocyclic compound
  • phenylsulfate
  • organic oxide
  • organic oxygen compound
  • sulfate-ester
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • sulfuric acid ester
  • organooxygen compound