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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:00 UTC
Update Date2025-03-25 00:55:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02215204
Frequency0.5
Structure
Chemical FormulaC10H16O2
Molecular Mass168.115
SMILESCC1=CCC(C)(O)C2CCC1O2
InChI KeyAEFLIFMVRAHAHT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tertiary alcohols
    • Substituents
  • alcohol
  • aliphatic heteropolycyclic compound
  • oxacycle
  • tertiary alcohol
  • ether
  • organic oxygen compound
  • tetrahydrofuran
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound