Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:57 UTC
Update Date2025-03-25 00:50:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02182964
Frequency0.5
Structure
Chemical FormulaC11H8O6S
Molecular Mass268.0042
SMILESO=c1cc(OS(=O)(=O)O)ccc2cccc(O)c12
InChI KeyYHXHDLHNNGCVEP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfuric acids and derivatives
Subclass arylsulfates
Direct Parent arylsulfates
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzenoids
  • organic oxides
  • organooxygen compounds
  • sulfuric acid monoesters
  • tropones
  • vinylogous acids
  • Substituents
  • sulfuric acid monoester
  • tropone
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • sulfate-ester
  • hydrocarbon derivative
  • arylsulfate
  • benzenoid
  • sulfuric acid ester
  • organooxygen compound