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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:18 UTC
Update Date2025-03-25 00:58:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02233977
Frequency0.5
Structure
Chemical FormulaC8H17NO2
Molecular Mass159.1259
SMILESCN(C)CC(O)C1(O)CCC1
InChI KeyZNYIITVYSPTYBO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent 1,3-aminoalcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • 1,2-diols
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • 1,3-aminoalcohol
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • tertiary alcohol
  • organic oxygen compound
  • cyclobutanol
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • tertiary amine
  • organooxygen compound
  • 1,2-diol