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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:50 UTC
Update Date2025-03-25 00:59:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02239709
Frequency0.5
Structure
Chemical FormulaC14H14N2O
Molecular Mass226.1106
SMILESNCC(O)c1ccc2[nH]c3ccccc3c2c1
InChI KeyXCOXVEFLRVNKCF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass carbazoles
Direct Parent carbazoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • azacycle
  • indole
  • heteroaromatic compound
  • carbazole
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound