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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:19 UTC
Update Date2025-03-21 18:35:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00106231
Frequency25.4
Structure
Chemical FormulaC5H10O3
Molecular Mass118.063
SMILESCC(O)C(O)CC=O
InChI KeyHAISXSGUXCZQJK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-hydroxy aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • alpha-hydrogen aldehydes
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • short-chain aldehydes
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • beta-hydroxy aldehyde
  • short-chain aldehyde
  • organic oxide
  • alpha-hydrogen aldehyde
  • secondary alcohol
  • hydrocarbon derivative
  • 1,2-diol