Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:02:48 UTC
Update Date2025-03-21 18:07:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00068876
Frequency43.9
Structure
Chemical FormulaC11H16O
Molecular Mass164.1201
SMILESCc1c(O)cccc1C(C)(C)C
InChI KeyMIHQWNKDHBLQEZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • organooxygen compounds
  • ortho cresols
  • toluenes
  • Substituents
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • o-cresol
  • phenol
  • hydrocarbon derivative
  • toluene
  • organooxygen compound