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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:41:44 UTC
Update Date2025-03-21 20:00:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00300527
Frequency6.6
Structure
Chemical FormulaC5H10O3
Molecular Mass118.063
SMILESO=CCCC(O)CO
InChI KeyLFRDGHVRPSURMV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydrogen aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • short-chain aldehydes
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • short-chain aldehyde
  • organic oxide
  • alpha-hydrogen aldehyde
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol
  • 1,2-diol