Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:06 UTC
Update Date2025-03-21 18:02:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00038777
Frequency90.1
Structure
Chemical FormulaC13H18O
Molecular Mass190.1358
SMILESC=C(C)c1cc(C(C)(C)C)ccc1O
InChI KeyOQBLGYWDTGJWHA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropenes
Direct Parent phenylpropenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • hydrocarbon derivatives
  • organooxygen compounds
  • phenylpropanes
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • phenylpropene
  • 1-hydroxy-2-unsubstituted benzenoid
  • phenol
  • hydrocarbon derivative
  • organooxygen compound