Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:52 UTC
Update Date2025-03-25 00:48:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169012
Frequency0.5
Structure
Chemical FormulaC12H22O2
Molecular Mass198.162
SMILESCC(C)C=CC1CCC(C(C)(C)O)O1
InChI KeyXAOBOGFIQKZUDT-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