Hmdb loader

Showing information for DMID00113434

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:17 UTC
Update Date2025-03-21 18:37:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00113434
Frequency23.3
Structure
Chemical FormulaC10H12O7S
Molecular Mass276.0304
SMILESO=C(O)C(CO)Cc1ccc(OS(=O)(=O)O)cc1
InChI KeySGJFXZOITCDTEZ-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
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • phenoxy compounds
  • phenylsulfates
  • primary alcohols
  • sulfuric acid monoesters
    • Substituents
  • alcohol
  • monocyclic benzene moiety
  • sulfuric acid monoester
  • carbonyl group
  • carboxylic acid
  • organic sulfuric acid or derivatives
  • 3-phenylpropanoic-acid
  • hydroxy acid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • phenylsulfate
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • sulfate-ester
  • hydrocarbon derivative
  • arylsulfate
  • benzenoid
  • phenoxy compound
  • sulfuric acid ester
  • primary alcohol
  • organooxygen compound