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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:29:02 UTC
Update Date2025-03-21 18:40:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00131913
Frequency19.2
Structure
Chemical FormulaC10H8O4
Molecular Mass192.0423
SMILESO=C(O)C(=O)C=Cc1cccc(O)c1
InChI KeyDBBSYZRJGGZZID-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcinnamic acids and derivatives
Subclass hydroxycinnamic acids and derivatives
Direct Parent hydroxycinnamic acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acryloyl compounds
  • alpha-hydroxy ketones
  • alpha-keto acids and derivatives
  • benzene and substituted derivatives
  • carboxylic acids
  • enones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • alpha,beta-unsaturated ketone
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • alpha-keto acid
  • enone
  • 1-hydroxy-4-unsubstituted benzenoid
  • hydroxycinnamic acid
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • keto acid
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • acryloyl-group
  • organooxygen compound