Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:36 UTC
Update Date2025-03-21 18:36:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00111799
Frequency23.8
Structure
Chemical FormulaC12H18O2
Molecular Mass194.1307
SMILESCc1cc(CO)c(O)c(C(C)(C)C)c1
InChI KeyOVXVAICEGAXQFZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • benzyl alcohols
  • hydrocarbon derivatives
  • para cresols
  • phenols
  • toluenes
  • Substituents
  • aromatic alcohol
  • alcohol
  • benzyl alcohol
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • p-cresol
  • phenol
  • hydrocarbon derivative
  • toluene
  • organooxygen compound