Hmdb loader

Showing information for DMID02185903

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:15 UTC
Update Date2025-03-25 00:51:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185903
Frequency0.5
Structure
Chemical FormulaC10H10O7S2
Molecular Mass305.9868
SMILESO=C(CCSc1ccc(C(=O)O)cc1)OS(=O)(=O)O
InChI KeyHUEWGWCTDDLWHY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent p-sulfanylbenzoic acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkylarylthioethers
  • benzoic acids
  • benzoyl derivatives
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • sulfenyl compounds
  • sulfuric acid monoesters
  • thiophenol ethers
  • thiophenols
    • Substituents
  • sulfuric acid monoester
  • carbonyl group
  • carboxylic acid
  • benzoyl
  • alkylarylthioether
  • organosulfur compound
  • carboxylic acid derivative
  • aryl thioether
  • organic oxide
  • thiophenol
  • thiophenol ether
  • benzoic acid
  • organic sulfuric acid or derivatives
  • sulfenyl compound
  • p-sulfanylbenzoic acid
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • thioether
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • sulfuric acid ester
  • organooxygen compound