Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:44 UTC
Update Date2025-03-21 18:35:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00104780
Frequency25.8
Structure
Chemical FormulaC11H16O
Molecular Mass164.1201
SMILESCc1ccccc1CC(C)(C)O
InChI KeyNWWKYANPAPELTR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • tertiary alcohols
  • toluenes
  • Substituents
  • phenylpropane
  • alcohol
  • aromatic homomonocyclic compound
  • tertiary alcohol
  • organic oxygen compound
  • hydrocarbon derivative
  • toluene
  • organooxygen compound