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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:47 UTC
Update Date2025-03-25 00:51:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02187136
Frequency0.5
Structure
Chemical FormulaC15H24O2
Molecular Mass236.1776
SMILESCC(C)(C)c1cc(O)c(C(C)(C)C)c(CO)c1
InChI KeyAOTTXXVIHXIQSJ-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
  • 1-hydroxy-4-unsubstituted benzenoids
  • aromatic alcohols
  • benzyl alcohols
  • hydrocarbon derivatives
    • Substituents
  • aromatic alcohol
  • alcohol
  • 1-hydroxy-2-unsubstituted benzenoid
  • benzyl alcohol
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • organooxygen compound