Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:46 UTC
Update Date2025-03-25 00:53:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02200743
Frequency0.5
Structure
Chemical FormulaC17H19NO2
Molecular Mass269.1416
SMILESCOc1ccc2c3c1OC1C4C=CCC31CN(C)C4C2
InChI KeyJHAZXPVBQIJIPN-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
  • azacyclic compounds
  • azepines
  • coumarans
  • hydrocarbon derivatives
  • organopnictogen compounds
  • oxacyclic compounds
  • piperidines
  • trialkylamines
  • Substituents
  • phenol ether
  • ether
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • azepine
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • benzazepine
  • piperidine
  • amine
  • tertiary amine
  • coumaran
  • organooxygen compound