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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:19 UTC
Update Date2025-03-25 00:51:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02186061
Frequency0.5
Structure
Chemical FormulaC22H18O5
Molecular Mass362.1154
SMILESO=C(C=Cc1ccc(O)c(O)c1)OC(c1ccccc1)c1ccc(O)cc1
InChI KeyOTMSITAQZMGKIY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzyloxycarbonyls
  • carbonyl compounds
  • enoate esters
  • fatty acid esters
  • hydrocarbon derivatives
  • hydroxycinnamic acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • benzyloxycarbonyl
  • enoate ester
  • fatty acyl
  • diphenylmethane
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxylic acid derivative
  • hydroxycinnamic acid or derivatives
  • hydroxycinnamic acid
  • aromatic homomonocyclic compound
  • alpha,beta-unsaturated carboxylic ester
  • fatty acid ester
  • cinnamic acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • phenol
  • hydrocarbon derivative
  • organooxygen compound