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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:03:35 UTC
Update Date2025-03-21 18:28:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00070723
Frequency42.5
Structure
Chemical FormulaC14H22O
Molecular Mass206.1671
SMILESCC1=CCC2C(OC2(C)C)C(C)=CCC1
InChI KeyBPKFNMYYAOXZRX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxetanes
Subclass oxetanes
Direct Parent oxetanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
    • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ether
  • organic oxygen compound
  • oxetane
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound