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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:21 UTC
Update Date2025-03-21 18:41:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134844
Frequency18.6
Structure
Chemical FormulaC19H20O8
Molecular Mass376.1158
SMILESCOc1cc(CCC(=O)OC(Cc2ccc(O)c(O)c2)C(=O)O)ccc1O
InChI KeyDQXFXJYLJQPKJI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classdepsides and depsidones
Subclass depsides and depsidones
Direct Parent depsides and depsidones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acid esters
  • hydrocarbon derivatives
  • methoxybenzenes
  • methoxyphenols
  • organic oxides
  • phenoxy compounds
  • phenylpropanoic acids
    • Substituents
  • fatty acyl
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • 3-phenylpropanoic-acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • methoxyphenol
  • alkyl aryl ether
  • carboxylic acid derivative
  • organic oxide
  • 1-hydroxy-4-unsubstituted benzenoid
  • methoxybenzene
  • aromatic homomonocyclic compound
  • fatty acid ester
  • organic oxygen compound
  • anisole
  • carboxylic acid ester
  • dicarboxylic acid or derivatives
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • depside backbone
  • organooxygen compound