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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:06 UTC
Update Date2025-03-21 18:33:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00098324
Frequency28.0
Structure
Chemical FormulaC13H18N2
Molecular Mass202.147
SMILESCc1cccc2c(CCN(C)C)c[nH]c12
InChI KeyPQSFTUCFMWBITK-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
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrroles
  • trialkylamines
    • Substituents
  • azacycle
  • indole
  • heteroaromatic compound
  • tertiary aliphatic amine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine