Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:19 UTC
Update Date2025-03-25 00:49:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176951
Frequency0.5
Structure
Chemical FormulaC22H28N2O
Molecular Mass336.2202
SMILESCOc1ccc2c3c1C1CC4C=CC(C=CC34CCN1C)N(C)CC2
InChI KeyIOBMXCPYSNPIOM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzazepines
Subclass benzazepines
Direct Parent benzazepines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • aralkylamines
  • azacyclic compounds
  • azepanes
  • azepines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • tetralins
  • trialkylamines
  • Substituents
  • tetralin
  • phenol ether
  • ether
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • aralkylamine
  • azepane
  • organic oxygen compound
  • azepine
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • benzazepine
  • amine
  • tertiary amine
  • organooxygen compound