Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:59 UTC
Update Date2025-03-25 00:46:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157971
Frequency0.5
Structure
Chemical FormulaC11H10O6
Molecular Mass238.0477
SMILESO=C(O)Cc1ccc(O)cc1CC(=O)C(=O)O
InChI KeyXGHNDPVXEXWBLT-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-hydroxy ketones
  • alpha-keto acids and derivatives
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • phenylpropanoic acids
  • Substituents
  • carbonyl group
  • carboxylic acid
  • phenylpyruvate
  • 3-phenylpropanoic-acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • keto acid
  • alpha-keto acid
  • dicarboxylic acid or derivatives
  • phenol
  • hydrocarbon derivative
  • organooxygen compound