<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">332800</id>
  <title nil="true"/>
  <common-name>3,7,15,19-tetrathiatricyclo[19.3.1.19,13]hexacosa-1(25),9(26),10,12,21,23-hexaene</common-name>
  <description>3,7,15,19-tetrathiatricyclo[19.3.1.19,13]hexacosa-1(25),9(26),10,12,21,23-hexaene is a chemical compound with the formula C22H28S4. It has an average molecular weight of 420.70 g/mol.</description>
  <cas>23088-84-8</cas>
  <pubchem-id>326905</pubchem-id>
  <chemical-formula>C22H28S4</chemical-formula>
  <weight>420.7</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">2026-08-30T14:01:46Z</created-at>
  <updated-at type="dateTime">2026-08-30T14:01:46Z</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>C1CSCC2=CC(=CC=C2)CSCCCSCC3=CC=CC(=C3)CSC1</moldb-smiles>
  <moldb-formula>C22H28S4</moldb-formula>
  <moldb-inchi>InChI=1S/C22H28S4/c1-5-19-13-20(6-1)16-24-10-4-12-26-18-22-8-2-7-21(14-22)17-25-11-3-9-23-15-19/h1-2,5-8,13-14H,3-4,9-12,15-18H2</moldb-inchi>
  <moldb-inchikey>MUFBCKHHBIEYFL-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">420.1073856</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>5.9</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>CHEM328693</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>3,7,15,19-tetrathiatricyclo[19.3.1.19,13]hexacosa-1(25),9(26),10,12,21,23-hexaene</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>Benzenoids</superklass>
  <klass nil="true"/>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0283302</sync-id>
  <structure-inchikey>MUFBCKHHBIEYFL-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>100000000000000000000200000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000010100000000100000000000000000400000000000000001000140000000000020000000000000000000000000801000000000000800000000000000000000000000000000000000000000000000000000008000000000000080000000010000000000000000000000000000000000000000000000000000000000000000000000000000000000200000000000000000000000000000040000000000000000000000000500000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>401000008112024001000900012820000000040000052000003520400200080c4022001202800000000041000080000004600024408c30010022643000a00000c6110c00028000000080100010720000000401804001013240000462002040000c28052400400200000004004514000020068050010180041108200002510002104000084ee0a0080c022250882c0008311c8812440014821020080020c04000408110000010c00002000948017c25101ac00000884108401080400000c0021000000084240000330180000000010280040004000200400009000a000800030000104800008100080000040041022000001000309042000e0000000050000000</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`������@(������@h�������@(������@h�������@h�������@h��������`������� ������`�������`�������`������� ������`������@(������@h�������@h�������@h�������@(������@h��������`������� ������`��������������������h���h���h���h��	h��
�
��������������������h���h���h���h���h�������������	�h���h�B�����������������
�����������	������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:35:01Z</structure-indexed-at>
</compound>
