Hmdb loader

Showing information for DMID00130095

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:17 UTC
Update Date2025-03-21 18:40:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00130095
Frequency19.5
Structure
Chemical FormulaC9H10O5S
Molecular Mass230.0249
SMILESO=C(O)C(Cc1ccccc1)S(=O)(=O)O
InChI KeySCOUCKCPPIIOCC-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
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organosulfonic acids
  • sulfonyls
    • Substituents
  • organosulfonic acid or derivatives
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • 3-phenylpropanoic-acid
  • organosulfonic acid
  • organosulfur compound
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound