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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:58:20 UTC
Update Date2025-03-24 20:07:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01343478
Frequency1.0
Structure
Chemical FormulaC8H13N
Molecular Mass123.1048
SMILESC1CCC2CCN=C2C1
InChI KeyIEWMLMIWOUFWAP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • ketimines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrrolines
    • Substituents
  • ketimine
  • azacycle
  • imine
  • indole
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteropolycyclic compound
  • pyrroline
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound