<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-04 23:50:46 UTC</creation_date>
  <update_date>2026-04-04 23:50:46 UTC</update_date>
  <accession/>
  <common_name>1-(1-L-alanyl-L-prolyl)-L-proline</common_name>
  <class>SmallMolecule</class>
  <description>1-(1-L-alanyl-L-prolyl)-L-proline is an organic compound with the chemical formula C13H21N3O4 and an average molecular weight of 283.33 g/mol. 1-(1-L-alanyl-L-prolyl)-L-proline belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds.

This substance is found in or released from three recorded sources. These sources include food, food processing, and cookware, specifically in the preparation of wort, as well as electrical and electronic equipment, including antennas and amplifiers.</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C13H21N3O4</chemical_formula>
  <average_molecular_weight>283.328</average_molecular_weight>
  <monisotopic_moleculate_weight>283.1532062</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>22049-75-8</cas_registry_number>
  <smiles>CC(N)C(=O)N1CCCC1C(=O)N1CCCC1C(O)=O</smiles>
  <inchi>InChI=1/C13H21N3O4/c1-8(14)11(17)15-6-2-4-9(15)12(18)16-7-3-5-10(16)13(19)20/h8-10H,2-7,14H2,1H3,(H,19,20)</inchi>
  <inchikey>OLVCTPPSXNRGKV-GUBZILKMSA-N</inchikey>
  <taxonomy>
    <kingdom/>
    <super_class/>
    <class/>
    <sub_class/>
    <direct_parent/>
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    <substituents/>
    <molecular_framework/>
    <descriptors/>
  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
  <biofluid_locations/>
  <tissue_locations/>
  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties/>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>283.328</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>283.1532062</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>CC(N)C(=O)N1CCCC1C(=O)N1CCCC1C(O)=O</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C13H21N3O4</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1/C13H21N3O4/c1-8(14)11(17)15-6-2-4-9(15)12(18)16-7-3-5-10(16)13(19)20/h8-10H,2-7,14H2,1H3,(H,19,20)</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>OLVCTPPSXNRGKV-GUBZILKMSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
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  <lethaldose/>
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  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f727fd04a78&gt;</health_effects>
  <symptoms/>
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  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>11558265</pubchem_compound_id>
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