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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:32:29 UTC
Update Date2025-03-21 18:42:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00139750
Frequency17.8
Structure
Chemical FormulaC8H9NO
Molecular Mass135.0684
SMILESON1CCc2ccccc21
InChI KeyRCMLKQSZCSYLLS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxylamino, 2-unsubstituted benzenoids
  • 1-hydroxylamino, 4-unsubstituted benzenoids
  • azacyclic compounds
  • hydrocarbon derivatives
  • n-organohydroxylamines
  • organic oxygen compounds
  • organopnictogen compounds
    • Substituents
  • azacycle
  • indole
  • n-organohydroxylamine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 1-hydroxylamino, 4-unsubstituted benzenoid
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • 1-hydroxylamino, 2-unsubstituted benzenoid