Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:46:58 UTC
Update Date2025-03-21 18:01:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00031277
Frequency117.9
Structure
Chemical FormulaC19H27NO
Molecular Mass285.2093
SMILESCOc1ccc2c(c1)C13CCCCC1C(C2)N(C)CCC3
InChI KeyJQCIVEDXRLAJCT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenanthrenes and derivatives
Subclass phenanthrenes and derivatives
Direct Parent phenanthrenes and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • azepanes
  • hydrocarbon derivatives
  • organopnictogen compounds
  • tetralins
  • trialkylamines
  • Substituents
  • tetralin
  • phenol ether
  • phenanthrene
  • ether
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • azepane
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound