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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:42 UTC
Update Date2025-03-25 00:52:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02195955
Frequency0.5
Structure
Chemical FormulaC10H16O6
Molecular Mass232.0947
SMILESCC1(C)OC2CC(=O)OC(C(O)CO)C2O1
InChI KeyVYXMVKUQGGTAEE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxolopyrans
Subclass dioxolopyrans
Direct Parent dioxolopyrans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • 1,3-dioxolanes
  • carbonyl compounds
  • carboxylic acid esters
  • delta valerolactones
  • hydrocarbon derivatives
  • ketals
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • meta-dioxolane
  • carbonyl group
  • delta valerolactone
  • carboxylic acid derivative
  • lactone
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • acetal
  • ketal
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • dioxolopyran
  • delta_valerolactone
  • organooxygen compound
  • 1,2-diol