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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:41 UTC
Update Date2025-03-25 00:54:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205113
Frequency0.5
Structure
Chemical FormulaC10H12O8S
Molecular Mass292.0253
SMILESO=S(=O)(O)OC1Oc2ccccc2OC1C(O)CO
InChI KeyHAKVJHMVLTVPAY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodioxanes
Subclass benzo-1,4-dioxanes
Direct Parent benzo-1,4-dioxanes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • alkyl aryl ethers
  • alkyl sulfates
  • benzenoids
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • para dioxins
  • primary alcohols
  • secondary alcohols
  • sulfuric acid monoesters
  • Substituents
  • alcohol
  • benzo-1,4-dioxane
  • sulfuric acid monoester
  • ether
  • organic sulfuric acid or derivatives
  • alkyl aryl ether
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • para-dioxin
  • aromatic heteropolycyclic compound
  • alkyl sulfate
  • secondary alcohol
  • sulfate-ester
  • hydrocarbon derivative
  • benzenoid
  • sulfuric acid ester
  • primary alcohol
  • organooxygen compound
  • 1,2-diol