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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:49 UTC
Update Date2025-03-21 18:40:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129021
Frequency19.7
Structure
Chemical FormulaC14H14O3
Molecular Mass230.0943
SMILESCOc1ccc2c3c1OC1C3C=CC(O)C1C2
InChI KeyQUUQIGSWHBYKNZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • coumarans
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • tetralin
  • phenol ether
  • ether
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • organoheterocyclic compound
  • coumaran
  • organooxygen compound