Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:51 UTC
Update Date2025-03-21 18:01:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00035760
Frequency99.4
Structure
Chemical FormulaC12H19NO
Molecular Mass193.1467
SMILESCOc1ccc(C(C)CN(C)C)cc1
InChI KeyXIBVWCVANOGMLT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropylamines
Direct Parent phenylpropylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • methoxybenzenes
  • organopnictogen compounds
  • phenoxy compounds
  • trialkylamines
  • Substituents
  • phenylpropylamine
  • phenol ether
  • ether
  • tertiary aliphatic amine
  • alkyl aryl ether
  • methoxybenzene
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • amine
  • tertiary amine
  • organooxygen compound