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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:09 UTC
Update Date2025-03-21 17:57:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00008835
Frequency550.9
Structure
Chemical FormulaC12H25NO2
Molecular Mass215.1885
SMILESCCCCCCCC=CC(O)C(N)CO
InChI KeyNCNKWPUJUUMFNR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
    • Substituents
  • aliphatic acyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • primary alcohol