Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:11 UTC
Update Date2025-03-25 00:46:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153927
Frequency0.5
Structure
Chemical FormulaC18H23NO
Molecular Mass269.178
SMILESCOc1ccc2cc(C(CN)C3CCCC3)ccc2c1
InChI KeyCGIHLVLJUDFINR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • phenol ether
  • ether
  • aromatic homopolycyclic compound
  • alkyl aryl ether
  • naphthalene
  • organic oxygen compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound