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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:40 UTC
Update Date2025-03-25 00:53:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02198169
Frequency0.5
Structure
Chemical FormulaC12H24N2O2
Molecular Mass228.1838
SMILESCCCCC=CC(O)C(O)=NCCN(C)C
InChI KeyRGZCIIARWOWYJU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent trialkylamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboximidic acids
  • hydrocarbon derivatives
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carboximidic acid
  • tertiary aliphatic amine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound