Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:42 UTC
Update Date2025-03-25 00:46:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155153
Frequency0.5
Structure
Chemical FormulaC13H20O
Molecular Mass192.1514
SMILESCc1cc(C)c(C(C)(C)C)cc1CO
InChI KeyKKDKSGBDUOXRDI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • benzyl alcohols
  • hydrocarbon derivatives
  • m-xylenes
  • Substituents
  • aromatic alcohol
  • alcohol
  • m-xylene
  • benzyl alcohol
  • phenylpropane
  • aromatic homomonocyclic compound
  • xylene
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound