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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:28 UTC
Update Date2025-03-25 00:53:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02197685
Frequency0.5
Structure
Chemical FormulaC6H15NO2
Molecular Mass133.1103
SMILESCCC(C)C(O)C(N)O
InChI KeyCTWRWNRKQFAAFC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent hemiaminals
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • hemiaminal
  • organic oxygen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organooxygen compound