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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:42 UTC
Update Date2025-03-25 00:47:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02164018
Frequency0.5
Structure
Chemical FormulaC20H28O2
Molecular Mass300.2089
SMILESCC1=CC(=O)CC(C)(C)C1Cc1c(C)c(C)c(O)c(C)c1C
InChI KeyNONYPOLGIILSGZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass cresols
Direct Parent meta cresols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • cyclohexenones
  • hydrocarbon derivatives
  • organic oxides
  • ortho cresols
  • phenols
    • Substituents
  • cyclohexenone
  • monocyclic benzene moiety
  • carbonyl group
  • m-cresol
  • cyclic ketone
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • o-cresol
  • hydrocarbon derivative
  • organooxygen compound