<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">294444</id>
  <title nil="true"/>
  <common-name>2-[[(2r)-2,3-di(propanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium</common-name>
  <description>2-[[(2r)-2,3-di(propanoyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium belongs to the glycerophosphocholines, a subclass of glycerophospholipids within the organic compounds. This compound has the formula C14H29NO8P+ and an average molecular weight of 370.36 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>5313786</pubchem-id>
  <chemical-formula>C14H29NO8P+</chemical-formula>
  <weight>370.36</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">2026-08-28T10:05:41Z</created-at>
  <updated-at type="dateTime">2026-08-28T10:05:41Z</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>CCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CC</moldb-smiles>
  <moldb-formula>C14H29NO8P+</moldb-formula>
  <moldb-inchi>InChI=1S/C14H28NO8P/c1-6-13(16)20-10-12(23-14(17)7-2)11-22-24(18,19)21-9-8-15(3,4)5/h12H,6-11H2,1-5H3/p+1/t12-/m1/s1</moldb-inchi>
  <moldb-inchikey>LMBVWVMURYPSQM-GFCCVEGCSA-O</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">370.1630789</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.2</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>CHEM290337</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(propanoyloxy)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>CED0245923</sync-id>
  <structure-inchikey>LMBVWVMURYPSQM-UHFFFAOYSA-O</structure-inchikey>
  <structure-fingerprint>40040000000000000400800000000204000010000000000080000000000000000000000002000001000000000000000000000002000000000000000002000000000000000000000110000000000008000020000000000500000000400000000000000000011000000000000000200000a00040000000000000000801000000000020000040000000000000000000000000000000000000002000000000000000000000000000000000008000002000000000000000000000000000000000000000000200000000000000100000000000000000000001080000000000000000000000000000020000000000000000000400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(�������`�������`�������`������� ������ ������(�������`������� ������`�������`������ "�������`�������`�������`�������(�������(�������(�������`�������`��������������(��� �������������	�	
��	��	����������������������� ��(�������B��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:06:03Z</structure-indexed-at>
</compound>
