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<compound>
  <version>1.0</version>
  <creation_date>2026-09-01 10:20:39 UTC</creation_date>
  <update_date>2026-09-01 10:20:39 UTC</update_date>
  <accession/>
  <common_name>(z)-4-(3-hydroxypropoxy)-4-oxobut-2-enoic acid</common_name>
  <class>SmallMolecule</class>
  <description>(z)-4-(3-hydroxypropoxy)-4-oxobut-2-enoic acid is a chemical compound with the formula C7H10O5. It has an average molecular weight of 174.15 g/mol.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C7H10O5</chemical_formula>
  <average_molecular_weight/>
  <monisotopic_moleculate_weight>174.0528234</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number/>
  <smiles>C(CO)COC(=O)C=CC(=O)O</smiles>
  <inchi>InChI=1S/C7H10O5/c8-4-1-5-12-7(11)3-2-6(9)10/h2-3,8H,1,4-5H2,(H,9,10)/b3-2-</inchi>
  <inchikey>CTEFDDZVRLFMNT-IHWYPQMZSA-N</inchikey>
  <taxonomy>
    <kingdom/>
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    <sub_class/>
    <direct_parent/>
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    <molecular_framework/>
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  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
  <biofluid_locations/>
  <tissue_locations/>
  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>-0.4</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>mono_mass</kind>
      <value>174.0528234</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>C(CO)COC(=O)C=CC(=O)O</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C7H10O5</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C7H10O5/c8-4-1-5-12-7(11)3-2-6(9)10/h2-3,8H,1,4-5H2,(H,9,10)/b3-2-</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>CTEFDDZVRLFMNT-IHWYPQMZSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
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  <metabolism/>
  <toxicity/>
  <lethaldose/>
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  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f727b146050&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>6433522</pubchem_compound_id>
  <chembl_id/>
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  <uniprot_id/>
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  <chebi_id/>
  <biocyc_id/>
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