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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:48 UTC
Update Date2025-03-25 01:00:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02244301
Frequency0.5
Structure
Chemical FormulaC9H17NO3
Molecular Mass187.1208
SMILESCCCC=CC=NC(O)C(O)CO
InChI KeyWRUJLZYNWXQKOD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent 1,2-diols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldimines
  • alkanolamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary alcohols
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • aliphatic acyclic compound
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aldimine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • alkanolamine
  • 1,2-diol