<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">21912</id>
  <title nil="true"/>
  <common-name>Eicosapentaenoic acid ethyl ester</common-name>
  <description nil="true"/>
  <cas>73310-10-8</cas>
  <pubchem-id>9831415</pubchem-id>
  <chemical-formula>C22H34O2</chemical-formula>
  <weight nil="true"/>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2016-05-22T07:26:55Z</created-at>
  <updated-at type="dateTime">2026-04-03T05:21:11Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>[H]\C(CCCCCCCCC)=C(/[H])\C(\[H])=C(\[H])/C(/[H])=C(/[H])\C(\[H])=C(\[H])/C(/[H])=C(/[H])C(=O)OCC</moldb-smiles>
  <moldb-formula>C22H34O2</moldb-formula>
  <moldb-inchi>InChI=1S/C22H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h12-21H,3-11H2,1-2H3/b13-12-,15-14-,17-16-,19-18-,21-20-</moldb-inchi>
  <moldb-inchikey>DTEMJWLYSQBXEL-FHLCVKDKSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">330.512</moldb-average-mass>
  <moldb-mono-mass type="decimal">330.255880335</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>8007147</chemspider-id>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM020807</chemdb-id>
  <dsstox-id>DTXSID7057814</dsstox-id>
  <toxcast-id>57814</toxcast-id>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00018703</susdat-id>
  <iupac>ethyl (2Z,4Z,6Z,8Z,10Z)-icosa-2,4,6,8,10-pentaenoate</iupac>
</compound>
