<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">355855</id>
  <title nil="true"/>
  <common-name>(1,1,2,3,3-pentadeuterio-2-hydroxy-3-nonadecanoyloxypropyl) nonadecanoate</common-name>
  <description>(1,1,2,3,3-pentadeuterio-2-hydroxy-3-nonadecanoyloxypropyl) nonadecanoate is a chemical compound with the formula C41H80O5. With an average molecular weight of 658.10 g/mol, (1,1,2,3,3-pentadeuterio-2-hydroxy-3-nonadecanoyloxypropyl) nonadecanoate is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>9543978</pubchem-id>
  <chemical-formula>C41H80O5</chemical-formula>
  <weight>658.1</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">2026-09-01T00:50:31Z</created-at>
  <updated-at type="dateTime">2026-09-01T00:50:31Z</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>CCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCC)O</moldb-smiles>
  <moldb-formula>C41H80O5</moldb-formula>
  <moldb-inchi>InChI=1S/C41H80O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-40(43)45-37-39(42)38-46-41(44)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h39,42H,3-38H2,1-2H3/i37D2,38D2,39D</moldb-inchi>
  <moldb-inchikey>VSZCJVIEISRCQF-PSNKSDIQSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">657.6319594</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>17.3</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>CHEM351748</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>(1,1,2,3,3-pentadeuterio-2-hydroxy-3-nonadecanoyloxypropyl) nonadecanoate</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>Glycerolipids</klass>
  <subklass>Diradylglycerols</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0306105</sync-id>
  <structure-inchikey>VSZCJVIEISRCQF-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000800000000200000010000000000000000000100000000000000002000000000000000000000000000000000000000000000000000000001000000000000000010000000000000020000004000100000000400000000000000020010000000000000000000000000000000000000000000000000000000000000040000000000000000000010000000000000020000000000000001000000000000000000000000000002001000000000008000000000000000000000000000008000000000000000000000000000000000000000000000000000000000000000000000000000000000000010400000000000000000000000000000200</structure-fingerprint>
  <structure-pattern-fingerprint>4000802005120e00090011008130a000000000008005206000380040020088044042000000800000000041200080000004600284008c10210044643000a00000c6110401088000000080102000720100000400004001003340000462040009000c200128004002200000000045340044200480500104610411080000025000025044080806e0800a08030250c82c0008311c180244409c0a5004082060408000004110110090c01000000860016435104ac000000801080000000800404002000000008414080022008004004000029808000000020040000960000008000204000048000881000013000000080220060050003080c2840c0000010050080000</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAuAAAALQAAAIABBgBgAAAAAQMGAGAAAAAC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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:53:44Z</structure-indexed-at>
</compound>
