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<compound>
  <version>1.0</version>
  <creation_date>2026-04-05 20:05:46 UTC</creation_date>
  <update_date>2026-04-05 20:05:46 UTC</update_date>
  <accession/>
  <common_name>Sulphosuccinic acid, sodium salt</common_name>
  <class>SmallMolecule</class>
  <description>Sulphosuccinic acid, sodium salt belongs to the fatty acids and conjugates, a subclass of fatty acyls within the organic compounds. It is classified under the superclass of lipids and lipid-like molecules and has the chemical formula C4H6O7S.xNa.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C4H6O7S.xNa</chemical_formula>
  <average_molecular_weight/>
  <monisotopic_moleculate_weight/>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number/>
  <smiles/>
  <inchi>InChI=1/C4H6O7S.Na/c5-3(6)1-2(4(7)8)12(9,10)11;/h2H,1H2,(H,5,6)(H,7,8)(H,9,10,11);/q;+1/p-1/rC4H5NaO7S/c5-12-13(10,11)2(4(8)9)1-3(6)7/h2H,1H2,(H,6,7)(H,8,9)</inchi>
  <inchikey>WQQPDTLGLVLNOH-UHFFFAOYSA-M</inchikey>
  <taxonomy>
    <kingdom/>
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    <class/>
    <sub_class/>
    <direct_parent/>
    <alternate_parents/>
    <substituents/>
    <molecular_framework/>
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  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
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  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties/>
  <predicted_properties>
    <property>
      <kind>formula</kind>
      <value>C4H6O7S.xNa</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1/C4H6O7S.Na/c5-3(6)1-2(4(7)8)12(9,10)11;/h2H,1H2,(H,5,6)(H,7,8)(H,9,10,11);/q;+1/p-1/rC4H5NaO7S/c5-12-13(10,11)2(4(8)9)1-3(6)7/h2H,1H2,(H,6,7)(H,8,9)</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>WQQPDTLGLVLNOH-UHFFFAOYSA-M</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
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  <metabolism/>
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  <lethaldose/>
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  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bbf8f9f60&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>23688068</pubchem_compound_id>
  <chembl_id/>
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  <biocyc_id/>
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