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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:14 UTC
Update Date2025-03-21 18:33:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00096178
Frequency28.8
Structure
Chemical FormulaC16H16O6
Molecular Mass304.0947
SMILESOc1cc(O)c2c(c1)C(c1ccc(O)c(O)c1)C(O)C(O)C2
InChI KeyGEMSIVVQBXEREK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1,2-diols
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • secondary alcohols
    • Substituents
  • alcohol
  • tetralin
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • organic oxygen compound
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • organooxygen compound
  • 1,2-diol