Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:44:06 UTC
Update Date2025-03-21 17:59:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00024511
Frequency158.9
Structure
Chemical FormulaC14H22O2
Molecular Mass222.162
SMILESCC(CO)Cc1ccc(C(O)C(C)C)cc1
InChI KeyZREAINCDSGXDSF-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
  • hydrocarbon derivatives
  • primary alcohols
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • phenylpropane
  • alcohol
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound