Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:34:46 UTC
Update Date2025-03-21 17:56:44 UTC
HMDB IDHMDB0304925
Metabolite Identification
DeepMet IDDMID00003289
Name2-Methoxy-4-methylphenol sulfate
Frequency1789.6
Structure
Chemical FormulaC8H10O5S
Molecular Mass218.0249
SMILESCOc1cc(C)ccc1OS(=O)(=O)O
InChI KeyLILXPJXZNJTPQZ-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
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • methoxybenzenes
  • organic oxides
  • phenoxy compounds
  • sulfuric acid monoesters
  • toluenes
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • sulfuric acid monoester
  • ether
  • alkyl aryl ether
  • methoxybenzene
  • aromatic homomonocyclic compound
  • phenylsulfate
  • organic oxide
  • organic oxygen compound
  • anisole
  • sulfate-ester
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • sulfuric acid ester
  • toluene
  • organooxygen compound