Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:30 UTC
Update Date2025-03-25 00:45:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149966
Frequency0.5
Structure
Chemical FormulaC38H70O
Molecular Mass542.5427
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCc1ccc(C)c(O)c1
InChI KeyMIMOKSCBWXWSSA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass cresols
Direct Parent ortho 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
  • o-cresol
  • 1-hydroxy-2-unsubstituted benzenoid
  • hydrocarbon derivative
  • 1-hydroxy-4-unsubstituted benzenoid
  • toluene
  • organooxygen compound