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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:55:59 UTC
Update Date2025-03-21 22:01:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00475676
Frequency3.6
Structure
Chemical FormulaC4H7NO3
Molecular Mass117.0426
SMILESN#CC(O)C(O)CO
InChI KeyYDXGXFDEPLKGAQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass organic cyanides
Direct Parent cyanohydrins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-hydroxynitriles
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • cyanohydrin
  • organic oxygen compound
  • alpha-hydroxynitrile
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound