<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">352578</id>
  <title nil="true"/>
  <common-name>1-[2-[bis(2-hydroxypropyl)amino]ethyl-(2-hydroxypropyl)amino]propan-2-yl octadec-9-enoate</common-name>
  <description>1-[2-[bis(2-hydroxypropyl)amino]ethyl-(2-hydroxypropyl)amino]propan-2-yl octadec-9-enoate is a chemical compound with the formula C32H64N2O5. With an average molecular weight of 556.90 g/mol, 1-[2-[bis(2-hydroxypropyl)amino]ethyl-(2-hydroxypropyl)amino]propan-2-yl octadec-9-enoate is a heavy molecule.</description>
  <cas>37599-16-9</cas>
  <pubchem-id>169940</pubchem-id>
  <chemical-formula>C32H64N2O5</chemical-formula>
  <weight>556.9</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">2026-08-31T19:00:03Z</created-at>
  <updated-at type="dateTime">2026-08-31T19:00:03Z</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>CCCCCCCCC=CCCCCCCCC(=O)OC(C)CN(CCN(CC(C)O)CC(C)O)CC(C)O</moldb-smiles>
  <moldb-formula>C32H64N2O5</moldb-formula>
  <moldb-inchi>InChI=1S/C32H64N2O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(38)39-31(5)27-34(26-30(4)37)23-22-33(24-28(2)35)25-29(3)36/h13-14,28-31,35-37H,6-12,15-27H2,1-5H3</moldb-inchi>
  <moldb-inchikey>QFKMMTALBTXNHD-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">556.4815232</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>7.3</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>CHEM348471</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-[2-[bis(2-hydroxypropyl)amino]ethyl-(2-hydroxypropyl)amino]propan-2-yl octadec-9-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>Organic compounds</kingdom>
  <superklass>Lipids and lipid-like molecules</superklass>
  <klass>Fatty Acyls</klass>
  <subklass>Fatty acid esters</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0302865</sync-id>
  <structure-inchikey>QFKMMTALBTXNHD-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400000000000000004008000000000000010000000000000000000001000001000000210020000000000000000000000000042004000000000000000000000000000000000000000000100000000000000200000000003000000000000000000018000200100000000000000000040000000400000000000000000000000000000000000c00000000000000000000100000000000000000000000000000010000000000000000000000800000020010000000000c8000000000000000000000010000008000000000000000000000000000000000000000000000010000000000000000000000000080000000000010400000001000000000000000000800000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������'���&amp;���€���`�������`�������`�������`�������`�������`�������`�������`�������h��������h��������`�������`�������`�������`�������`�������`�������`�������(�������(�������(�������`�������`�������`������� ������`�������`������� ������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������������������������������	��	
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  <structure-indexed-at type="dateTime">2026-09-19T05:50:18Z</structure-indexed-at>
</compound>
