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<compound>
  <version>1.0</version>
  <creation_date>2026-08-20 01:33:59 UTC</creation_date>
  <update_date>2026-08-20 01:33:59 UTC</update_date>
  <accession/>
  <common_name>(z)-2-nitrooctadec-9-enoic acid</common_name>
  <class>SmallMolecule</class>
  <description>(z)-2-nitrooctadec-9-enoic acid belongs to the fatty acids and conjugates, a subclass of fatty acyls within the organic compounds. This lipid-like molecule has the formula C18H33NO4 and an average molecular weight of 327.50 g/mol.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C18H33NO4</chemical_formula>
  <average_molecular_weight>327.5</average_molecular_weight>
  <monisotopic_moleculate_weight>327.2409585</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number/>
  <smiles/>
  <inchi>InChI=1S/C18H33NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18(20)21)19(22)23/h9-10,17H,2-8,11-16H2,1H3,(H,20,21)/b10-9-</inchi>
  <inchikey>YDIQDTPFXHYJHI-KTKRTIGZSA-N</inchikey>
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    <kingdom/>
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    <class/>
    <sub_class/>
    <direct_parent/>
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  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
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  <tissue_locations/>
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  <state/>
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  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>7.2</value>
    </property>
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  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>327.5</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>327.2409585</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C18H33NO4</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C18H33NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18(20)21)19(22)23/h9-10,17H,2-8,11-16H2,1H3,(H,20,21)/b10-9-</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>YDIQDTPFXHYJHI-KTKRTIGZSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
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  <pubchem_compound_id>86656470</pubchem_compound_id>
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