<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">277029</id>
  <title nil="true"/>
  <common-name>[2-hydroxy-3-[2-(2-hydroxy-3-prop-2-enoyloxypropoxy)ethoxy]propyl] prop-2-enoate</common-name>
  <description>[2-hydroxy-3-[2-(2-hydroxy-3-prop-2-enoyloxypropoxy)ethoxy]propyl] prop-2-enoate is a chemical compound with the formula C28H44O16. With an average molecular weight of 636.60 g/mol, [2-hydroxy-3-[2-(2-hydroxy-3-prop-2-enoyloxypropoxy)ethoxy]propyl] prop-2-enoate is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>160481819</pubchem-id>
  <chemical-formula>C28H44O16</chemical-formula>
  <weight>636.6</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">2026-08-26T16:50:52Z</created-at>
  <updated-at type="dateTime">2026-08-26T16:50:52Z</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>C=CC(=O)OCC(COCCOCC(COC(=O)C=C)O)O.C=CC(=O)OCC(COCCOCC(COC(=O)C=C)O)O</moldb-smiles>
  <moldb-formula>C28H44O16</moldb-formula>
  <moldb-inchi>InChI=1S/2C14H22O8/c2*1-3-13(17)21-9-11(15)7-19-5-6-20-8-12(16)10-22-14(18)4-2/h2*3-4,11-12,15-16H,1-2,5-10H2</moldb-inchi>
  <moldb-inchikey>QPJZPXVJPPJNMF-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">636.2629353</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <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>CHEM272922</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-hydroxy-3-[2-(2-hydroxy-3-prop-2-enoyloxypropoxy)ethoxy]propyl] prop-2-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 nil="true"/>
  <superklass nil="true"/>
  <klass nil="true"/>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0229215</sync-id>
  <structure-inchikey>QPJZPXVJPPJNMF-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40040000000000000000800000000200000010000000000000000000100000000000000000000000000000000000000000000010000000000000000000000800001000000000000000000000000000000020000000000300000000000000000000000000010000000000000002000000000000000000000100000000000000000000000000004000000000000000000000000000000020000000000000000000000000000000000000000200000000000000000000000000000000000000000000000000000000000000000000044000000000000000000000000000000000000020000000000000000100000000000400000000000000000080000000000200</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������,���*���€���h��������h��������(�������(�������(�������`�������`�������`������� ������`�������`������� ������`�������`�������`�������(�������(�������(�������h��������h��������`�������`�������h��������h��������(�������(�������(�������`�������`�������`������� ������`�������`������� ������`�������`�������`�������(�������(�������(�������h��������h��������`�������`��������(��� ��(��� �������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:52:45Z</structure-indexed-at>
</compound>
