Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:15 UTC
Update Date2025-03-21 18:41:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00136917
Frequency18.3
Structure
Chemical FormulaC16H22N2O
Molecular Mass258.1732
SMILESCOc1ccc2c(c1)C13CCNC1C(C2)N(C)CC3
InChI KeyOGOYIVJBGFRAGG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzazocines
Direct Parent benzazocines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • indoles
  • organopnictogen compounds
  • piperidines
  • pyrrolidines
  • tetralins
  • trialkylamines
  • Substituents
  • tetralin
  • phenol ether
  • ether
  • indole
  • alkyl aryl ether
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • piperidine
  • tertiary amine
  • organoheterocyclic compound
  • secondary aliphatic amine
  • azacycle
  • tertiary aliphatic amine
  • indole or derivatives
  • secondary amine
  • organic oxygen compound
  • anisole
  • benzazocine
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound