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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:10 UTC
Update Date2025-03-25 00:47:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162825
Frequency0.5
Structure
Chemical FormulaC17H18O3
Molecular Mass270.1256
SMILESO=C(Cc1ccc(O)cc1)C(CO)Cc1ccccc1
InChI KeyZHDZBVZMQRICIM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslignans, neolignans and related compounds
ClassNot Available
Subclass lignans, neolignans and related compounds
Direct Parent lignans, neolignans and related compounds
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • beta-hydroxy ketones
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
    • Substituents
  • alcohol
  • beta-hydroxy ketone
  • monocyclic benzene moiety
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • norlignan skeleton
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • primary alcohol
  • organooxygen compound