<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">359422</id>
  <title nil="true"/>
  <common-name>(3-icosanoyloxy-2-tetradecanoyloxypropyl) icosanoate</common-name>
  <description>(3-icosanoyloxy-2-tetradecanoyloxypropyl) icosanoate is a chemical compound with the formula C57H110O6. With an average molecular weight of 891.50 g/mol, (3-icosanoyloxy-2-tetradecanoyloxypropyl) icosanoate is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>131756478</pubchem-id>
  <chemical-formula>C57H110O6</chemical-formula>
  <weight>891.5</weight>
  <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">2026-09-01T07:30:44Z</created-at>
  <updated-at type="dateTime">2026-09-01T07:30:44Z</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>CCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC</moldb-smiles>
  <moldb-formula>C57H110O6</moldb-formula>
  <moldb-inchi>InChI=1S/C57H110O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-35-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-34-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-36-33-31-29-27-25-23-20-17-14-11-8-5-2/h54H,4-53H2,1-3H3</moldb-inchi>
  <moldb-inchikey>KKBWDSMULWDHME-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">890.8302412</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>25.2</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <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>CHEM355315</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>(3-icosanoyloxy-2-tetradecanoyloxypropyl) icosanoate</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Lipids and lipid-like molecules</superklass>
  <klass>Glycerolipids</klass>
  <subklass>Triradylcglycerols</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0309634</sync-id>
  <structure-inchikey>KKBWDSMULWDHME-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000400800000000204000010000000000000000000000000000000000002000000000000000000000000000000000000000000000000000000000000000000000000010000000000000020000004000100000000400000000000000020010000000000000000000000000000000000000000000001000000000000000040000000000000000000010000000000000000002000000000001000000000000000000000000000002001000000000048000000000000000000000000000008000000000000100000000000000000000000000000000000000000000000000000000000000000000000010400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������?���&gt;���€���`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������(�������(�������(�������`�������`�������`�������(�������(�������(�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������(�������(�������(�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:56:56Z</structure-indexed-at>
</compound>
