Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:01 UTC
Update Date2025-03-25 00:59:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02235694
Frequency0.5
Structure
Chemical FormulaC21H25NO3
Molecular Mass339.1834
SMILESCOc1ccc2c(c1)CC1C2c2cc(OC)c(OC)cc2CCN1C
InChI KeyNMCSMCUGCHFQPK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdibenzazecins
Subclass dibenzazecins
Direct Parent dibenzazecins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • azepines
  • benzazepines
  • hydrocarbon derivatives
  • indanes
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • phenol ether
  • ether
  • dibenzazecin
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • organic oxygen compound
  • azepine
  • aromatic heteropolycyclic compound
  • anisole
  • indane
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • benzazepine
  • amine
  • tertiary amine
  • organooxygen compound