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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:58:07 UTC
Update Date2025-03-24 20:58:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01629033
Frequency0.8
Structure
Chemical FormulaC6H13NO
Molecular Mass115.0997
SMILESCCCC(C)(N)C=O
InChI KeyHXSIDQLZBMYZGC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass organonitrogen compounds
Direct Parent organonitrogen compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • aldehyde
  • hydrocarbon derivative
  • primary aliphatic amine
  • organooxygen compound