Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:36 UTC
Update Date2025-03-21 18:01:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00035149
Frequency101.7
Structure
Chemical FormulaC4H9NO3
Molecular Mass119.0582
SMILESNCC(O)C(O)C=O
InChI KeyJIDVIMQFVJVPPX-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
  • 1,2-diols
  • alpha-hydroxyaldehydes
  • beta-hydroxy aldehydes
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • beta-hydroxy aldehyde
  • carbonyl group
  • monosaccharide
  • aldehyde
  • organic oxide
  • alpha-hydroxyaldehyde
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,2-diol