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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:07:34 UTC
Update Date2025-03-24 16:40:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00932538
Frequency1.5
Structure
Chemical FormulaC4H7NO3
Molecular Mass117.0426
SMILESNCC(=O)C(O)C=O
InChI KeyZGJHYZRGCNDTTD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • acyloins
  • alpha-hydroxy ketones
  • alpha-hydroxyaldehydes
  • beta ketoaldehydes
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • beta-ketoaldehyde
  • monosaccharide
  • aldehyde
  • alpha-hydroxy ketone
  • ketone
  • organic oxide
  • alpha-hydroxyaldehyde
  • acyloin
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-dicarbonyl compound