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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:04:10 UTC
Update Date2025-03-21 18:28:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00072140
Frequency41.5
Structure
Chemical FormulaC6H12O7
Molecular Mass196.0583
SMILESOCC1OC(O)(CO)OC(O)C1O
InChI KeyCVMDPIWGQCVOOA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,3-dioxanes
Direct Parent 1,3-dioxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hemiacetals
  • hydrocarbon derivatives
  • orthocarboxylic acid derivatives
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • oxacycle
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • orthocarboxylic acid derivative
  • primary alcohol
  • meta-dioxane
  • organooxygen compound