Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:14 UTC
Update Date2025-03-25 01:01:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02249943
Frequency0.5
Structure
Chemical FormulaC19H23NO2
Molecular Mass297.1729
SMILESCOc1ccc2c3c1OC1C4C=CCC(C2)N(C)CCC31C4
InChI KeyPXNZZOMLDRXYSW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classcoumarans
Subclass coumarans
Direct Parent coumarans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • oxacyclic compounds
  • trialkylamines
  • Substituents
  • phenol ether
  • ether
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine
  • coumaran
  • organooxygen compound