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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:49 UTC
Update Date2025-03-25 00:57:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02226207
Frequency0.5
Structure
Chemical FormulaC11H16O3
Molecular Mass196.1099
SMILESCC(O)(CCCO)c1ccc(O)cc1
InChI KeyUQIOBVBPPRLUFT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • tertiary alcohols
    • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • tertiary alcohol
  • organic oxygen compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • hydrocarbon derivative
  • organooxygen compound