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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:26 UTC
Update Date2025-03-21 18:40:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00130491
Frequency19.4
Structure
Chemical FormulaC17H24O2
Molecular Mass260.1776
SMILESC=CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1
InChI KeyFRHOIYVCBXWNAX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha,beta-unsaturated ketones
  • aryl ketones
  • benzoyl derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • phenols
    • Substituents
  • benzoyl
  • alpha,beta-unsaturated ketone
  • ketone
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • organooxygen compound
  • aryl ketone