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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:33 UTC
Update Date2025-03-25 00:46:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154807
Frequency0.5
Structure
Chemical FormulaC17H21NO
Molecular Mass255.1623
SMILESCOc1ccc(C(C)C(CN)c2ccccc2)cc1
InChI KeyNGZXQEXGHWGJHH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classstilbenes
Subclass stilbenes
Direct Parent stilbenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • methoxybenzenes
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • phenylpropanes
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • alkyl aryl ether
  • methoxybenzene
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound
  • stilbene