Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:19 UTC
Update Date2025-03-25 00:50:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02179237
Frequency0.5
Structure
Chemical FormulaC26H29NO2
Molecular Mass387.2198
SMILESCOc1ccc(C2OC(CCCN(C)C)(c3ccccc3)c3ccccc32)cc1
InChI KeyFBBJVZWPYKRHRA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylbutylamines
Direct Parent phenylbutylamines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • dialkyl ethers
  • hydrocarbon derivatives
  • isocoumarans
  • methoxybenzenes
  • organopnictogen compounds
  • oxacyclic compounds
  • phenoxy compounds
  • trialkylamines
  • Substituents
  • phenol ether
  • ether
  • tertiary aliphatic amine
  • alkyl aryl ether
  • methoxybenzene
  • dialkyl ether
  • oxacycle
  • phenylbutylamine
  • isocoumaran
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound