Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:28 UTC
Update Date2025-03-21 18:34:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00099189
Frequency27.7
Structure
Chemical FormulaC18H25NO
Molecular Mass271.1936
SMILESCOc1ccc2c(c1)C13CCCCC(C1C2)N(C)CC3
InChI KeyNOBFBRSFQLJMJM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanes
Direct Parent indanes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • piperidines
  • trialkylamines
  • Substituents
  • phenol ether
  • ether
  • azacycle
  • tertiary aliphatic amine
  • alkyl aryl ether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • indane
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound