Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:52 UTC
Update Date2025-03-21 18:38:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00119689
Frequency21.8
Structure
Chemical FormulaC15H17NO2
Molecular Mass243.1259
SMILESCOc1ccc2c3c1OC1C2C2CC31CCN2C
InChI KeyNCOSTIXXFUSQEH-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
  • azepanes
  • coumarans
  • hydrocarbon derivatives
  • indanes
  • organopnictogen compounds
  • oxacyclic compounds
  • piperidines
  • trialkylamines
  • Substituents
  • tetralin
  • phenol ether
  • ether
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • oxacycle
  • azepane
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • indane
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • coumaran
  • organooxygen compound