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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:55:25 UTC
Update Date2025-03-25 00:52:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02190821
Frequency0.5
Structure
Chemical FormulaC13H18O2
Molecular Mass206.1307
SMILESC=C(C)c1cc(C(C)(C)C)c(O)cc1O
InChI KeyPKCDNOSQOZRMDQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropenes
Direct Parent phenylpropenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • hydrocarbon derivatives
  • organooxygen compounds
  • phenylpropanes
  • resorcinols
    • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • phenylpropene
  • 1-hydroxy-2-unsubstituted benzenoid
  • phenol
  • hydrocarbon derivative
  • organooxygen compound
  • resorcinol