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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:46 UTC
Update Date2025-03-21 18:38:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00119451
Frequency21.8
Structure
Chemical FormulaC12H17N3
Molecular Mass203.1422
SMILESCN(C)CCc1c[nH]c2ccc(N)cc12
InChI KeyKYXMPXCAXJDUTQ-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
  • primary amines
  • pyrroles
  • trialkylamines
    • Substituents
  • azacycle
  • indole
  • heteroaromatic compound
  • tertiary aliphatic amine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • amine
  • tertiary amine