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<compound>
  <id type="integer">86202</id>
  <title nil="true"/>
  <common-name>Disodium 3,3'-[(3,3'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis(4-aminonaphthalene-1-sulphonate)</common-name>
  <description>Disodium 3,3'-[(3,3'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis(4-aminonaphthalene-1-sulphonate) belongs to the biphenyls and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. It is classified under the superclass of benzenoids and has the formula C32H22Cl2N6O6S2. With an average molecular weight of 765.60 g/mol, Disodium 3,3'-[(3,3'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis(4-aminonaphthalene-1-sulphonate) is a heavy molecule.</description>
  <cas>6470-31-1</cas>
  <pubchem-id>22977</pubchem-id>
  <chemical-formula>C32H22Cl2N6O6S2</chemical-formula>
  <weight>765.6</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">2026-04-04T21:18:01Z</created-at>
  <updated-at type="dateTime">2026-04-17T18:11:11Z</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>C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)[O-])N)Cl)Cl)S(=O)(=O)[O-].[Na+].[Na+]</moldb-smiles>
  <moldb-formula>C32H22Cl2N6O6S2</moldb-formula>
  <moldb-inchi>InChI=1/C32H22Cl2N6O6S2.2Na/c33-23-13-17(9-11-25(23)37-39-27-15-29(47(41,42)43)19-5-1-3-7-21(19)31(27)35)18-10-12-26(24(34)14-18)38-40-28-16-30(48(44,45)46)20-6-2-4-8-22(20)32(28)36;;/h1-16H,35-36H2,(H,41,42,43)(H,44,45,46);;/q;2*+1/p-2</moldb-inchi>
  <moldb-inchikey>NRXDNEXGDVFWIR-UHFFFAOYSA-L</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">720.0419298</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>CHEM082095</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00046478</susdat-id>
  <iupac nil="true"/>
  <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>Benzene and substituted derivatives</klass>
  <subklass>Biphenyls and derivatives</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0159542</sync-id>
  <structure-inchikey>NRXDNEXGDVFWIR-UHFFFAOYSA-L</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T04:30:44Z</structure-indexed-at>
</compound>
