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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:58:38 UTC
Update Date2025-03-21 18:54:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00201055
Frequency11.1
Structure
Chemical FormulaC9H11N
Molecular Mass133.0891
SMILESCc1ccc2c(c1)CCN2
InChI KeyJFUAVVHABJWSFX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • indolines
  • organopnictogen compounds
  • secondary alkylarylamines
    • Substituents
  • azacycle
  • indole
  • secondary amine
  • secondary aliphatic/aromatic amine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • dihydroindole
  • amine