<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">345643</id>
  <title nil="true"/>
  <common-name>[(2r)-3-[(2r)-3-[(2r)-2,3-dihydroxypropoxy]-2-hydroxypropoxy]-2-pentanoyloxypropyl] dodecanoate</common-name>
  <description>[(2r)-3-[(2r)-3-[(2r)-2,3-dihydroxypropoxy]-2-hydroxypropoxy]-2-pentanoyloxypropyl] dodecanoate is a chemical compound with the formula C26H50O9. With an average molecular weight of 506.70 g/mol, [(2r)-3-[(2r)-3-[(2r)-2,3-dihydroxypropoxy]-2-hydroxypropoxy]-2-pentanoyloxypropyl] dodecanoate is a heavy molecule.</description>
  <cas>72347-88-7</cas>
  <pubchem-id>3085795</pubchem-id>
  <chemical-formula>C26H50O9</chemical-formula>
  <weight>506.7</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">2026-08-31T08:34:17Z</created-at>
  <updated-at type="dateTime">2026-08-31T08:34:17Z</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>CCCCCCCCCCCC(=O)OCC(COCC(COCC(CO)O)O)OC(=O)CCCC</moldb-smiles>
  <moldb-formula>C26H50O9</moldb-formula>
  <moldb-inchi>InChI=1S/C26H50O9/c1-3-5-7-8-9-10-11-12-13-15-25(30)34-21-24(35-26(31)14-6-4-2)20-33-19-23(29)18-32-17-22(28)16-27/h22-24,27-29H,3-21H2,1-2H3/t22-,23-,24-/m1/s1</moldb-inchi>
  <moldb-inchikey>RNUFZCXHBHHJGV-WXFUMESZSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">506.3454832</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.4</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>CHEM341536</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>[(2r)-3-[(2r)-3-[(2r)-2,3-dihydroxypropoxy]-2-hydroxypropoxy]-2-pentanoyloxypropyl] dodecanoate</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>Triradylcglycerols</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0295999</sync-id>
  <structure-inchikey>RNUFZCXHBHHJGV-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000400800000000204000010000000000000000002100000000000000002000800000000000000000000000000000000000000000020000000000200000000000000010000000000000020000004000100000000400000000000000020010000000000000002000000000000000000000000000001000000000000000040000000000000000000010000000000000020002000000000001000000000000000000000000000002001000000000848000000000000000000000000000008000000000000100000000000000000000000000000000000000000000000000000000000000000000000010400000000000000400080000000000200</structure-fingerprint>
  <structure-pattern-fingerprint>4000802005120e0089001100012820000000000000052000003000400200080c4002001000800000000041000080000004600284008c10210004643000a04000c6110400008004000080102000720100000400004001003240000422000009000c20012a004002000000000045340004200080500105e1041108000002100002504400080ee0800808020250882c0008311c0812444094021004082020408080004110010090c00000000860016d35100ac00000880108001000080000400200000000840408002200800400000102900800000002004000096000000800020000004810088100001000000000022004005000308042800c0000010050000000</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAjAAAAIgAAAIABBgBgAAAAAQMGAGAAAAAC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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:44:37Z</structure-indexed-at>
</compound>
