Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:47 UTC
Update Date2025-03-25 00:51:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189425
Frequency0.5
Structure
Chemical FormulaC13H20O
Molecular Mass192.1514
SMILESCC(C)c1ccccc1C(C)(C)CO
InChI KeyYBEQCHQHMYUKND-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cumenes
Direct Parent cumenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • phenylpropanes
  • Substituents
  • phenylpropane
  • alcohol
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • cumene
  • hydrocarbon derivative
  • organooxygen compound