<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">277241</id>
  <title nil="true"/>
  <common-name>2-[methyl-bis(2-tetradecanoyloxyethylsulfanyl)stannyl]sulfanylethyl tetradecanoate</common-name>
  <description>2-[methyl-bis(2-tetradecanoyloxyethylsulfanyl)stannyl]sulfanylethyl tetradecanoate belongs to the tricarboxylic acids and derivatives, a subclass of carboxylic acids and derivatives within the organic compounds. It has the chemical formula C49H96O6S3Sn. With an average molecular weight of 996.20 g/mol, 2-[methyl-bis(2-tetradecanoyloxyethylsulfanyl)stannyl]sulfanylethyl tetradecanoate is a heavy molecule.</description>
  <cas>68928-38-1</cas>
  <pubchem-id>111793</pubchem-id>
  <chemical-formula>C49H96O6S3Sn</chemical-formula>
  <weight>996.2</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">2026-08-26T17:03:23Z</created-at>
  <updated-at type="dateTime">2026-08-26T17:03:23Z</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>CCCCCCCCCCCCCC(=O)OCCS[Sn](C)(SCCOC(=O)CCCCCCCCCCCCC)SCCOC(=O)CCCCCCCCCCCCC</moldb-smiles>
  <moldb-formula>C49H96O6S3Sn</moldb-formula>
  <moldb-inchi>InChI=1S/3C16H32O2S.CH3.Sn/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-16(17)18-14-15-19;;/h3*19H,2-15H2,1H3;1H3;/q;;;;+3/p-3</moldb-inchi>
  <moldb-inchikey>XPLRHMJDCOKZLS-UHFFFAOYSA-K</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">996.539107</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>CHEM273134</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-[methyl-bis(2-tetradecanoyloxyethylsulfanyl)stannyl]sulfanylethyl tetradecanoate</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>Organic acids and derivatives</superklass>
  <klass>Carboxylic acids and derivatives</klass>
  <subklass>Tricarboxylic acids and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0229405</sync-id>
  <structure-inchikey>XPLRHMJDCOKZLS-UHFFFAOYSA-K</structure-inchikey>
  <structure-fingerprint>40000000000000000800000000800000010000000000000000000002000000000000002000000000000000000000000000000000000000000000000000000000000000000000000010000000000000020000004000100000000000000000000000020010000000000000000000000000000000000000000000000000000000020000040000000000000000000010000000002080000000000000000001000200000000000000000000000002001200000000008000000000000000000000000000008000000800000000000000008000000000000000000000000000000000000000000000000080000000000010400000000000000000008000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������;���:���€���`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������(�������(�������(�������`�������`������� ����2  ������`������� ������`�������`�������(�������(�������(�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`������� ������`�������`�������(�������(�������(�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:52:58Z</structure-indexed-at>
</compound>
