Hmdb loader

Showing information for DMID00126299

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:41 UTC
Update Date2025-03-21 18:39:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00126299
Frequency20.3
Structure
Chemical FormulaC13H9Cl2NO5S
Molecular Mass360.9578
SMILESNS(=O)(=O)c1ccc(Oc2ccc(Cl)cc2Cl)c(C(=O)O)c1
InChI KeyGZJRVPWFJRRXKD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylethers
Direct Parent diphenylethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • aminosulfonyl compounds
  • aryl chlorides
  • benzenesulfonamides
  • benzenesulfonyl compounds
  • benzoic acids
  • benzoyl derivatives
  • diarylethers
  • dichlorobenzenes
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic nitrogen compounds
  • organic oxides
  • organochlorides
  • organosulfonamides
  • phenol ethers
  • phenoxy compounds
    • Substituents
  • diaryl ether
  • phenol ether
  • organosulfonic acid or derivatives
  • ether
  • carboxylic acid
  • organochloride
  • benzoyl
  • organosulfur compound
  • carboxylic acid derivative
  • organohalogen compound
  • 1,3-dichlorobenzene
  • organosulfonic acid amide
  • organic oxide
  • 1-carboxy-2-haloaromatic compound
  • benzoic acid
  • benzenesulfonyl group
  • aryl chloride
  • chlorobenzene
  • benzenesulfonamide
  • aminosulfonyl compound
  • benzoic acid or derivatives
  • aryl halide
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • phenoxy compound
  • diphenylether
  • organooxygen compound