Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:36 UTC
Update Date2025-03-25 00:47:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159327
Frequency0.5
Structure
Chemical FormulaC11H12O9S
Molecular Mass320.0202
SMILESO=S(=O)(O)OC1c2cc3c(cc2C(O)C(O)C1O)OCO3
InChI KeyVEOGADYZGZZFGP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • alkyl sulfates
  • benzodioxoles
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • secondary alcohols
  • sulfuric acid monoesters
  • Substituents
  • alcohol
  • tetralin
  • sulfuric acid monoester
  • organic sulfuric acid or derivatives
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • alkyl sulfate
  • secondary alcohol
  • sulfate-ester
  • hydrocarbon derivative
  • sulfuric acid ester
  • organoheterocyclic compound
  • organooxygen compound
  • benzodioxole