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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:49 UTC
Update Date2025-03-25 00:45:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150696
Frequency0.5
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESC=CC1(C)OC=CC1(C)O
InChI KeyDGWSZKJLUKKHQU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass dihydrofurans
Direct Parent dihydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tertiary alcohols
    • Substituents
  • alcohol
  • oxacycle
  • tertiary alcohol
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound
  • dihydrofuran