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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:51 UTC
Update Date2025-03-25 01:01:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251372
Frequency0.5
Structure
Chemical FormulaC10H13NO2
Molecular Mass179.0946
SMILESOc1ccc(C2CCCN2O)cc1
InChI KeyCUVKWYKYYNDALN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass phenylpyrrolidines
Direct Parent phenylpyrrolidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • azacyclic compounds
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • n-organohydroxylamines
  • organooxygen compounds
  • organopnictogen compounds
  • pyrroles
    • Substituents
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • azacycle
  • 2-phenylpyrrolidine
  • 1-hydroxy-2-unsubstituted benzenoid
  • n-organohydroxylamine
  • organic oxygen compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound