Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:10 UTC
Update Date2025-03-25 00:47:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162811
Frequency0.5
Structure
Chemical FormulaC16H14O4
Molecular Mass270.0892
SMILESO=C(Cc1ccc(O)cc1)C(=O)OCc1ccccc1
InChI KeyDAAYSJSWWDQROE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpyruvic acid derivatives
Direct Parent phenylpyruvic acid derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alpha-keto acids and derivatives
  • benzyloxycarbonyls
  • carboxylic acid esters
  • fatty acid esters
  • hydrocarbon derivatives
  • ketones
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • benzyloxycarbonyl
  • fatty acyl
  • carbonyl group
  • phenylpyruvate
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • ketone
  • aromatic homomonocyclic compound
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • keto acid
  • carboxylic acid ester
  • alpha-keto acid
  • phenol
  • hydrocarbon derivative
  • organooxygen compound