Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:49:55 UTC
Update Date2025-03-21 18:02:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00038387
Frequency91.2
Structure
Chemical FormulaC13H20O
Molecular Mass192.1514
SMILESCCc1cc(C)cc(C(C)(C)C)c1O
InChI KeySXAKTPPFZAVMJR-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
  • organooxygen compounds
  • para cresols
  • phenols
  • toluenes
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • p-cresol
  • phenol
  • hydrocarbon derivative
  • toluene
  • organooxygen compound