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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:55:51 UTC
Update Date2025-03-21 18:04:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00052453
Frequency62.0
Structure
Chemical FormulaC8H19NO3
Molecular Mass177.1365
SMILESCCN(CCO)CCOCCO
InChI KeyVJEOGLCTHXUEDD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent 1,2-aminoalcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • dialkyl ethers
  • hydrocarbon derivatives
  • organopnictogen compounds
  • trialkylamines
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • ether
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • dialkyl ether
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • tertiary amine
  • organooxygen compound