<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">359193</id>
  <title nil="true"/>
  <common-name>[3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(4z,7z,10z,13z,16z,19z)-docosa-4,7,10,13,16,19-hexaenoyl]oxypropyl] (z)-tetracos-15-enoate</common-name>
  <description>[3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(4z,7z,10z,13z,16z,19z)-docosa-4,7,10,13,16,19-hexaenoyl]oxypropyl] (z)-tetracos-15-enoate is a compound with the formula C53H92NO8P. With an average molecular weight of 902.30 g/mol, [3-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(4z,7z,10z,13z,16z,19z)-docosa-4,7,10,13,16,19-hexaenoyl]oxypropyl] (z)-tetracos-15-enoate is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>131821764</pubchem-id>
  <chemical-formula>C53H92NO8P</chemical-formula>
  <weight>902.3</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">2026-09-01T07:07:12Z</created-at>
  <updated-at type="dateTime">2026-09-01T07:07:12Z</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>CCCCCCCCC=CCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN(C)C)OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC</moldb-smiles>
  <moldb-formula>C53H92NO8P</moldb-formula>
  <moldb-inchi>InChI=1S/C53H92NO8P/c1-5-7-9-11-13-15-17-19-21-23-25-26-28-29-31-33-35-37-39-41-43-45-52(55)59-49-51(50-61-63(57,58)60-48-47-54(3)4)62-53(56)46-44-42-40-38-36-34-32-30-27-24-22-20-18-16-14-12-10-8-6-2/h8,10,14,16,19-22,27,30,34,36,40,42,51H,5-7,9,11-13,15,17-18,23-26,28-29,31-33,35,37-39,41,43-50H2,1-4H3,(H,57,58)/b10-8-,16-14-,21-19-,22-20-,30-27-,36-34-,42-40-</moldb-inchi>
  <moldb-inchikey>MJGNUIONCDLPMP-AEDCMAJTSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">901.6560559</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>13.7</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>CHEM355086</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-[2-(dimethylamino)ethoxy-hydroxyphosphoryl]oxy-2-[(4z,7z,10z,13z,16z,19z)-docosa-4,7,10,13,16,19-hexaenoyl]oxypropyl] (z)-tetracos-15-enoate</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>Glycerophospholipids</klass>
  <subklass>Glycerophosphoethanolamines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0309408</sync-id>
  <structure-inchikey>MJGNUIONCDLPMP-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400400000100000004008000000002040000100000040000800020000000000000000000020000000000000000000000000040000000000000000000020000000000000000000000000100000000000000280000040007000000004000040000010000200110000000000000002040008000000000000000000008010000000000000000400000000000000000020100001000000010000020000000000010000000200000000000000800000020010000000000c8020000000000000000000000000208000000000000100000000000020000000000080000000010000000000000000000020000000040000000010400000001000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAA/AAAAPgAAAIABBgBgAAAAAQMGAGAAAAAC
AgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAA
AAACAgYAaAAAAAMDAQYAaAAAAAMDAQYAYAAAAAICBgBgAAAAAgIGAGAAAAAC
AgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAA
AAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgAoAAAAAwQI
ACgAAAADAggAKAAAAAMCBgBgAAAAAgIGAGAAAAADAQYAYAAAAAICCAAgAAAA
Ag8AIAAAAAUIACgAAAADAggAYAAAAAEBCAAgAAAAAgYAYAAAAAICBgBgAAAA
AgIHACAAAAADBgBgAAAAAQMGAGAAAAABAwgAKAAAAAMCBgAoAAAAAwQIACgA
AAADAgYAYAAAAAICBgBgAAAAAgIGAGgAAAADAwEGAGgAAAADAwEGAGAAAAAC
AgYAaAAAAAMDAQYAaAAAAAMDAQYAYAAAAAICBgBoAAAAAwMBBgBoAAAAAwMB
BgBgAAAAAgIGAGgAAAADAwEGAGgAAAADAwEGAGAAAAACAgYAaAAAAAMDAQYA
aAAAAAMDAQYAYAAAAAICBgBoAAAAAwMBBgBoAAAAAwMBBgBgAAAAAgIGAGAA
AAABAwsAAQABAgACAwADBAAEBQAFBgAGBwAHCAAICQgCCQoACgsACwwADA0A
DQ4ADg8ADxAAEBEAERIAEhMAExQAFBUAFRYAFhcAFxgoAhcZIBkaABobABsc
ABwdAB0eAB4fCAIeIAAeIQAhIgAiIwAjJAAkJQAkJgAbJwAnKCAoKSgCKCoA
KisAKywALC0IAi0uAC4vAC8wCAIwMQAxMgAyMwgCMzQANDUANTYIAjY3ADc4
ADg5CAI5OgA6OwA7PAgCPD0APT4AQgAAAAAXBAAAAAAAAAAW
</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:56:44Z</structure-indexed-at>
</compound>
