Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:24 UTC
Update Date2025-03-21 17:57:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00009406
Frequency513.0
Structure
Chemical FormulaC14H20O2
Molecular Mass220.1463
SMILESCC(C)c1cc(C=O)cc(C(C)(C)C)c1O
InChI KeyLIRWNWJSMSKRIB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cumenes
Direct Parent cumenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzoyl derivatives
  • hydrocarbon derivatives
  • hydroxybenzaldehydes
  • organic oxides
  • organooxygen compounds
  • phenols
  • phenylpropanes
  • Substituents
  • benzoyl
  • aldehyde
  • phenylpropane
  • aromatic homomonocyclic compound
  • benzaldehyde
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • phenol
  • cumene
  • hydrocarbon derivative
  • hydroxybenzaldehyde
  • organooxygen compound