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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:49 UTC
Update Date2025-03-25 00:49:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02175775
Frequency0.5
Structure
Chemical FormulaC11H20O2
Molecular Mass184.1463
SMILESCC1C=CC(C)(C)OC1C(C)(C)O
InChI KeyOBNYSKKOAQBDOX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyrans
Direct Parent pyrans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tertiary alcohols
    • Substituents
  • alcohol
  • oxacycle
  • tertiary alcohol
  • ether
  • organic oxygen compound
  • pyran
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound