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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:48 UTC
Update Date2025-03-21 18:34:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00102479
Frequency26.6
Structure
Chemical FormulaC17H19NO3
Molecular Mass285.1365
SMILESCOc1ccc2c3c1OC14C=CC(O)C31CCN(C)C4C2
InChI KeyHLWVZWADWSSEFS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • coumarans
  • hydrocarbon derivatives
  • organopnictogen compounds
  • oxacyclic compounds
  • piperidines
  • secondary alcohols
  • trialkylamines
    • Substituents
  • alcohol
  • tetralin
  • phenol ether
  • ether
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • coumaran
  • organooxygen compound