Hmdb loader

Showing information for DMID02185931

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:16 UTC
Update Date2025-03-25 00:51:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185931
Frequency0.5
Structure
Chemical FormulaC15H12O7S
Molecular Mass336.0304
SMILESO=C(Cc1ccc(OS(=O)(=O)O)cc1)C(=O)c1ccc(O)cc1
InChI KeyMEOHITFGQNDVOP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classlinear 1,3-diarylpropanoids
Subclass chalcones and dihydrochalcones
Direct Parent retro-dihydrochalcones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alpha-diketones
  • aryl ketones
  • benzoyl derivatives
  • butyrophenones
  • cinnamylphenols
  • hydrocarbon derivatives
  • organic oxides
  • phenoxy compounds
  • phenylsulfates
  • sulfuric acid monoesters
    • Substituents
  • monocyclic benzene moiety
  • sulfuric acid monoester
  • carbonyl group
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • cinnamylphenol
  • retro-dihydrochalcone
  • ketone
  • phenylsulfate
  • organic oxide
  • arylsulfate
  • organic sulfuric acid or derivatives
  • alpha-diketone
  • butyrophenone
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • sulfate-ester
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • sulfuric acid ester
  • organooxygen compound
  • aryl ketone