Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:35:59 UTC
Update Date2025-03-21 17:57:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00006089
Frequency857.9
Structure
Chemical FormulaC10H10O4
Molecular Mass194.0579
SMILESO=C(O)CC(C(=O)O)c1ccccc1
InChI KeyLVFFZQQWIZURIO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classphenylpropanoic acids
Subclass phenylpropanoic acids
Direct Parent phenylpropanoic acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • 3-phenylpropanoic-acid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound