Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:06:34 UTC
Update Date2025-03-21 18:29:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00077966
Frequency37.6
Structure
Chemical FormulaC12H18O
Molecular Mass178.1358
SMILESCC(C)c1cccc(C(C)CO)c1
InChI KeyFNDLKNHPVKYEIG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cumenes
Direct Parent cumenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • phenylpropanes
  • primary alcohols
  • Substituents
  • phenylpropane
  • alcohol
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • cumene
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound