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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:39 UTC
Update Date2025-03-21 18:31:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00085280
Frequency33.5
Structure
Chemical FormulaC11H15NO
Molecular Mass177.1154
SMILESCOc1ccc(C2(C)CNC2)cc1
InChI KeyZCNHYACCYQCDSU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazetidines
Subclass phenylazetidines
Direct Parent phenylazetidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • methoxybenzenes
  • organopnictogen compounds
  • phenoxy compounds
    • Substituents
  • phenol ether
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • ether
  • aromatic heteromonocyclic compound
  • azacycle
  • 3-phenylazetidine
  • alkyl aryl ether
  • secondary amine
  • methoxybenzene
  • organic oxygen compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound
  • amine