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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:24 UTC
Update Date2025-03-21 18:39:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00125603
Frequency20.4
Structure
Chemical FormulaC16H16O4
Molecular Mass272.1049
SMILESO=C(CCc1ccc(O)cc1)Cc1cc(O)cc(O)c1
InChI KeyIFDNAAZDJICXHF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass benzenediols
Direct Parent resorcinols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
    • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • resorcinol
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound