Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:51:22 UTC
Update Date2025-03-21 18:03:01 UTC
HMDB IDHMDB0038985
Metabolite Identification
DeepMet IDDMID00041786
Name3-Ethyl-5-methylphenol
Frequency82.1
Structure
Chemical FormulaC9H12O
Molecular Mass136.0888
SMILESCCc1cc(C)cc(O)c1
InChI KeyXTCHLXABLZQNNN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass cresols
Direct Parent meta cresols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • organooxygen compounds
  • toluenes
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxygen compound
  • m-cresol
  • 1-hydroxy-2-unsubstituted benzenoid
  • hydrocarbon derivative
  • 1-hydroxy-4-unsubstituted benzenoid
  • toluene
  • organooxygen compound