Hmdb loader

Showing information for DMID00101673

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:28 UTC
Update Date2025-03-21 18:34:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00101673
Frequency26.8
Structure
Chemical FormulaC10H12O5S
Molecular Mass244.0405
SMILESCC(C(=O)O)c1ccc(CS(=O)(=O)O)cc1
InChI KeyNMVKIWQTOINXFH-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
  • aromatic monoterpenoids
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • organosulfonic acids
  • sulfonyls
    • Substituents
  • monoterpenoid
  • organosulfonic acid or derivatives
  • monocyclic benzene moiety
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • organosulfonic acid
  • p-cymene
  • organosulfur compound
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • sulfonyl
  • organic oxygen compound
  • 2-phenylpropanoic-acid
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aromatic monoterpenoid