Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:22 UTC
Update Date2025-03-25 01:00:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02240955
Frequency0.5
Structure
Chemical FormulaC16H24O3
Molecular Mass264.1725
SMILESCC(C)(C)c1cc(C(C)(C)C)c(CO)c(C=O)c1O
InChI KeyBYGYCLPIUUEQGJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • benzoyl derivatives
  • benzyl alcohols
  • hydrocarbon derivatives
  • hydroxybenzaldehydes
  • organic oxides
  • phenols
  • vinylogous acids
  • Substituents
  • aromatic alcohol
  • alcohol
  • benzoyl
  • aldehyde
  • benzyl alcohol
  • phenylpropane
  • aromatic homomonocyclic compound
  • vinylogous acid
  • benzaldehyde
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • hydroxybenzaldehyde
  • organooxygen compound