Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:39:03 UTC
Update Date2025-03-24 20:24:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01440623
Frequency0.9
Structure
Chemical FormulaC6H8O2
Molecular Mass112.0524
SMILESCC12CC(O1)C1OC12
InChI KeyXMJRGPYLGWMTEW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,4-dioxanes
Direct Parent 1,4-dioxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxanes
  • oxetanes
  • tetrahydrofurans
  • Substituents
  • ether
  • tetrahydrofuran
  • oxirane
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • para-dioxane
  • oxetane
  • hydrocarbon derivative
  • oxane
  • organooxygen compound