Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:04 UTC
Update Date2025-03-21 18:41:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134209
Frequency18.7
Structure
Chemical FormulaC12H18O
Molecular Mass178.1358
SMILESCc1ccc(CC(C)CO)cc1C
InChI KeyYKCOVECTDOBZAN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • primary alcohols
  • o-xylenes
  • Substituents
  • phenylpropane
  • alcohol
  • aromatic homomonocyclic compound
  • xylene
  • o-xylene
  • organic oxygen compound
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound