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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:07 UTC
Update Date2025-03-21 18:35:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105715
Frequency25.5
Structure
Chemical FormulaC11H14O4
Molecular Mass210.0892
SMILESCC1c2c(O)cc(O)cc2CC(O)C1O
InChI KeyBMZRPWUZXDVEFG-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
  • hydrocarbon derivatives
  • secondary alcohols
    • Substituents
  • alcohol
  • tetralin
  • organic oxygen compound
  • secondary alcohol
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • 1-hydroxy-4-unsubstituted benzenoid
  • organooxygen compound
  • 1,2-diol