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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:25 UTC
Update Date2025-03-25 01:00:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245767
Frequency0.5
Structure
Chemical FormulaC13H16O2
Molecular Mass204.115
SMILESCC1CCC(c2ccc(O)cc2)CC1=O
InChI KeyLEOMVLVJEBJOHO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cyclohexylphenols
Direct Parent cyclohexylphenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
    • Substituents
  • cyclohexylphenol
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • cyclic ketone
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • organooxygen compound