<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">359355</id>
  <title nil="true"/>
  <common-name>2-[[(2r)-2,3-di(tetracosanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium</common-name>
  <description>2-[[(2r)-2,3-di(tetracosanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium is a compound with the formula C56H113NO8P+. With an average molecular weight of 959.50 g/mol, 2-[[(2r)-2,3-di(tetracosanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>5313737</pubchem-id>
  <chemical-formula>C56H113NO8P+</chemical-formula>
  <weight>959.5</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">2026-09-01T07:24:00Z</created-at>
  <updated-at type="dateTime">2026-09-01T07:24:00Z</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>CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCC</moldb-smiles>
  <moldb-formula>C56H113NO8P+</moldb-formula>
  <moldb-inchi>InChI=1S/C56H112NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-46-48-55(58)62-52-54(53-64-66(60,61)63-51-50-57(3,4)5)65-56(59)49-47-45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h54H,6-53H2,1-5H3/p+1/t54-/m1/s1</moldb-inchi>
  <moldb-inchikey>XOAMGMFHUNHBEM-AXAMJWTMSA-O</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">958.8203816</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>22.2</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>CHEM355248</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>2-[[(2r)-2,3-di(tetracosanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium</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>Glycerophosphocholines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0309567</sync-id>
  <structure-inchikey>XOAMGMFHUNHBEM-UHFFFAOYSA-O</structure-inchikey>
  <structure-fingerprint>40040000000000000400800000000204000010000000000080000000000000000000000002000001000000000000000000000002000000000000000002000000000000000000000010010000000008000020000004000100000000400000000000000020011000000000000000200000800040000000000000000801000000000020000040000000000000000000010000000000000000002000000000001000000000000000000000008000002001000000000048000000000000000000000000000208000000000000100000000000000000000000080000000000000000000000000000020000000000000000010400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������B���A���€���`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������(�������(�������(�������`�������`�������`������� ������ ������(�������`������� ������`�������`������ "�������`�������`�������`�������(�������(�������(�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������������������������������	�	
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��������������������������������������(��� �������������������� ��!�!"�"#�#$�$%�$&amp;�$'��(�() )*(�)+�+,�,-�-.�./�/0�01�12�23�34�45�56�67�78�89�9:�:;�;&lt;�&lt;=�=&gt;�&gt;?�?@�@A�B��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:56:52Z</structure-indexed-at>
</compound>
