Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:07 UTC
Update Date2025-03-25 01:00:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245041
Frequency0.5
Structure
Chemical FormulaC17H20N2O
Molecular Mass268.1576
SMILESCN1c2ccccc2OC1(CCCN)c1ccccc1
InChI KeyYTMGIBRZFUBTDT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylbutylamines
Direct Parent phenylbutylamines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzoxazolines
  • dialkylarylamines
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • azacycle
  • benzoxazoline
  • oxacycle
  • phenylbutylamine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • dialkylarylamine
  • organoheterocyclic compound
  • organooxygen compound