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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:21:27 UTC
Update Date2025-03-24 16:48:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00966088
Frequency1.5
Structure
Chemical FormulaC6H13NO
Molecular Mass115.0997
SMILESCC(O)C1CN(C)C1
InChI KeyMCGGNCUHFFNTAE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent 1,3-aminoalcohols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
    • Substituents
  • alcohol
  • 1,3-aminoalcohol
  • azacycle
  • tertiary aliphatic amine
  • azetidine
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound