Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:48 UTC
Update Date2025-03-25 00:52:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02193905
Frequency0.5
Structure
Chemical FormulaC11H14O2
Molecular Mass178.0994
SMILESCCc1cc(C)c(C=O)c(O)c1C
InChI KeyUZJDGMVJQHWTNY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent p-xylenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzoyl derivatives
  • hydrocarbon derivatives
  • hydroxybenzaldehydes
  • meta cresols
  • organic oxides
  • organooxygen compounds
  • ortho cresols
  • vinylogous acids
  • p-xylenes
  • Substituents
  • m-cresol
  • benzoyl
  • aldehyde
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • vinylogous acid
  • benzaldehyde
  • organic oxide
  • p-xylene
  • aryl-aldehyde
  • organic oxygen compound
  • o-cresol
  • p-xylenol
  • phenol
  • hydrocarbon derivative
  • hydroxybenzaldehyde
  • organooxygen compound