Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:57 UTC
Update Date2025-03-21 18:39:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124531
Frequency20.6
Structure
Chemical FormulaC13H18O
Molecular Mass190.1358
SMILESCC=Cc1ccc(O)c(C(C)(C)C)c1
InChI KeyBXKAXGFXJZZGOX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • phenol
  • hydrocarbon derivative
  • organooxygen compound