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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:28 UTC
Update Date2025-03-25 00:52:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02193153
Frequency0.5
Structure
Chemical FormulaC15H22O3
Molecular Mass250.1569
SMILESCCCC1(C)COc2c(C)c(O)c(C)c(C)c2O1
InChI KeyICPPSHOGKYOFCV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodioxanes
Subclass benzo-1,4-dioxanes
Direct Parent benzo-1,4-dioxanes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • benzenoids
  • hydrocarbon derivatives
  • oxacyclic compounds
  • para dioxins
    • Substituents
  • benzo-1,4-dioxane
  • ether
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • para-dioxin
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound