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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:42 UTC
Update Date2025-03-21 18:40:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00131146
Frequency19.3
Structure
Chemical FormulaC12H22O2
Molecular Mass198.162
SMILESC=CC1(C)CCC(C(C)(O)C(C)C)O1
InChI KeyZAPOWEHHBCDMDW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tertiary alcohols
    • Substituents
  • alcohol
  • oxacycle
  • tertiary alcohol
  • ether
  • organic oxygen compound
  • tetrahydrofuran
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound