Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:28 UTC
Update Date2025-03-25 00:59:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02236657
Frequency0.5
Structure
Chemical FormulaC17H19NO3
Molecular Mass285.1365
SMILESCOc1ccc2c3c1CC1N(C)CCC34C(C=CC14O)O2
InChI KeyJJGROUCTUMWBLV-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
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • tetralin
  • phenol ether
  • ether
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • oxacycle
  • tertiary alcohol
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • coumaran
  • organooxygen compound