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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:44:46 UTC
Update Date2025-03-24 20:53:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01597282
Frequency0.8
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESC=C1CC2CC1OC2(C)C
InChI KeyLRJFZSHCNQEERV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tetrahydrofurans
    • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ether
  • organic oxygen compound
  • tetrahydrofuran
  • hydrocarbon derivative
  • oxane
  • dialkyl ether
  • organooxygen compound