Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:26 UTC
Update Date2025-03-21 18:38:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00120993
Frequency21.5
Structure
Chemical FormulaC18H21NO3
Molecular Mass299.1521
SMILESCOc1ccc2c3c1C31CCN(C)C(C2)C2C=CC(O)C1O2
InChI KeyOWTYDFCGHKGXBK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • azacyclic compounds
  • dialkyl ethers
  • hydrocarbon derivatives
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrans
  • secondary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • ether
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • pyran
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound