<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">286107</id>
  <title nil="true"/>
  <common-name>2-[[(2r)-2-acetyloxy-3-ethoxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium</common-name>
  <description>2-[[(2r)-2-acetyloxy-3-ethoxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium belongs to the glycerophosphocholines, a subclass of glycerophospholipids within the organic compounds. This compound has the formula C12H27NO7P+ and an average molecular weight of 328.32 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>461545</pubchem-id>
  <chemical-formula>C12H27NO7P+</chemical-formula>
  <weight>328.32</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">2026-08-27T22:00:10Z</created-at>
  <updated-at type="dateTime">2026-08-27T22:00:10Z</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>CCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C</moldb-smiles>
  <moldb-formula>C12H27NO7P+</moldb-formula>
  <moldb-inchi>InChI=1S/C12H26NO7P/c1-6-17-9-12(20-11(2)14)10-19-21(15,16)18-8-7-13(3,4)5/h12H,6-10H2,1-5H3/p+1/t12-/m1/s1</moldb-inchi>
  <moldb-inchikey>OLGKYSVSAKLUHK-GFCCVEGCSA-O</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">328.1525142</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.8</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>CHEM282000</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-acetyloxy-3-ethoxypropoxy]-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>CED0237922</sync-id>
  <structure-inchikey>OLGKYSVSAKLUHK-UHFFFAOYSA-O</structure-inchikey>
  <structure-fingerprint>40040000000000000400800000000204000000000000000080000000000000000000000002000001000000000000000000000002000000000000000002000000000000000000000010010000000008000020000000000100000000000000000000000000011000000004000000200008800040000000000000000800000000400030000840000000000000000000000000000000000000002000020000000000000000000000000000008000000020000000000000000000000000000000000000000200000000000000000000000000000000000000080000000000000000000000000000020000000000000000000400000000000000000080000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`�������`������� ������ ������(�������`������� ������`�������`������ "�������`�������`�������`�������(�������(�������(�������`��������������������������������	��
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  <structure-indexed-at type="dateTime">2026-09-19T04:59:51Z</structure-indexed-at>
</compound>
