<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">108642</id>
  <title nil="true"/>
  <common-name>Aurothiomalate</common-name>
  <description>Aurothiomalate belongs to the fatty acids and conjugates, a subclass of fatty acyls within the organic compounds. It has the chemical formula C4H5AuO4S and an average molecular weight of 346.11 g/mol. It is classified as a lipid and lipid-like molecule.</description>
  <cas nil="true"/>
  <pubchem-id nil="true"/>
  <chemical-formula>C4H5AuO4S</chemical-formula>
  <weight nil="true"/>
  <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">2026-04-05T16:16:09Z</created-at>
  <updated-at type="dateTime">2026-04-05T16:16:09Z</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>[Au+].OC(=O)CC([S-])C(O)=O</moldb-smiles>
  <moldb-formula>C4H5AuO4S</moldb-formula>
  <moldb-inchi>InChI=1S/C4H6O4S.Au/c5-3(6)1-2(9)4(7)8;/h2,9H,1H2,(H,5,6)(H,7,8);/q;+1/p-1</moldb-inchi>
  <moldb-inchikey>XJHSMFDIQHVMCY-UHFFFAOYSA-M</moldb-inchikey>
  <moldb-average-mass type="decimal">346.11</moldb-average-mass>
  <moldb-mono-mass type="decimal">345.9574233</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>CHEM104535</chemdb-id>
  <dsstox-id>DTXSID80329685</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00076425</susdat-id>
  <iupac>Gold(1+) 1,2-dicarboxyethane-1-thiolate</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 acids and conjugates</subklass>
  <paper-count type="integer">1783</paper-count>
  <sync-id>CED0006858</sync-id>
  <structure-inchikey>XJHSMFDIQHVMCY-UHFFFAOYSA-M</structure-inchikey>
  <structure-fingerprint>40000000200000000000800000000000000000000000000000000000000000000000000000000000000000000000000004000000000000000000000000000000000000000002000000000000000000000020000000000000000000000000000000000000010000000000000800000010000000000000000000000000000000000000000000000000000000000000050000000000000000000000000000000000002000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000100000000000000000400000000000000000000000000800000000000000000400000000000000000000002000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������
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  <structure-indexed-at type="dateTime">2026-09-19T04:43:12Z</structure-indexed-at>
</compound>
