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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:49:44 UTC
Update Date2025-03-25 00:28:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02037810
Frequency0.6
Structure
Chemical FormulaC4H6O5
Molecular Mass134.0215
SMILESOC1OC2OC(O2)C1O
InChI KeyYDZQCAXPPJYIPW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,3-dioxanes
Direct Parent 1,3-dioxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dioxetanes
  • hemiacetals
  • hydrocarbon derivatives
  • orthocarboxylic acid derivatives
  • oxacyclic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • 1,3-dioxetane
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • orthocarboxylic acid derivative
  • meta-dioxane
  • organooxygen compound