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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:53:16 UTC
Update Date2025-03-21 18:03:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00046408
Frequency72.2
Structure
Chemical FormulaC7H11NO4
Molecular Mass173.0688
SMILESO=C(C(O)CO)C1CCC(O)=N1
InChI KeyJPNCUDDUKUIQPH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • acyloins
  • azacyclic compounds
  • beta-hydroxy ketones
  • cyclic carboximidic acids
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • propargyl-type 1,3-dipolar organic compounds
  • pyrrolines
  • secondary alcohols
    • Substituents
  • beta-hydroxy ketone
  • carbonyl group
  • monosaccharide
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • organoheterocyclic compound
  • 1,2-diol
  • alcohol
  • azacycle
  • organic 1,3-dipolar compound
  • pyrroline
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • cyclic carboximidic acid