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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:55 UTC
Update Date2025-03-25 00:51:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185112
Frequency0.5
Structure
Chemical FormulaC15H13NO5
Molecular Mass287.0794
SMILESNC(=O)Cc1ccc(OC(=O)c2ccc(O)c(O)c2)cc1
InChI KeyKMXOTDVALISEHT-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
  • benzoyl derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenol esters
  • phenoxy compounds
  • phenylacetamides
  • primary carboxylic acid amides
  • m-hydroxybenzoic acid esters
  • p-hydroxybenzoic acid esters
    • Substituents
  • primary carboxylic acid amide
  • monocyclic benzene moiety
  • carbonyl group
  • p-hydroxybenzoic acid ester
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • benzoate ester
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • m-hydroxybenzoic acid ester
  • phenylacetamide
  • benzoic acid or derivatives
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxamide group
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • phenol ester
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound
  • depside backbone