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<compound>
  <id type="integer">62879</id>
  <title nil="true"/>
  <common-name>Direct Violet 48</common-name>
  <description>Direct Violet 48 belongs to the naphthalene sulfonic acids and derivatives, a subclass of naphthalenes within the organic compounds. It is a benzenoid with the chemical formula C34H29N7O14S4. With an average molecular weight of 1,055 g/mol, Direct Violet 48 is a heavy molecule.</description>
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  <pubchem-id nil="true"/>
  <chemical-formula>C34H29N7O14S4</chemical-formula>
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  <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">2026-04-02T22:42:18Z</created-at>
  <updated-at type="dateTime">2026-05-20T17:15:54Z</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>[Na+].[Na+].[Cu++].[Cu++].CNS(=O)(=O)C1=CC=C([O-])C(=C1)N=NC1=C([O-])C2=C(C=C(NC3=CC4=C(C=C3)C([O-])=C(N=NC3=CC(=CC=C3[O-])S(=O)(=O)NC)C(=C4)S([O-])(=O)=O)C=C2)C=C1S([O-])(=O)=O</moldb-smiles>
  <moldb-formula>C34H29N7O14S4</moldb-formula>
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  <moldb-inchikey>XVOQVFIKRANUSY-IRGIMFCPSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">1054.9</moldb-average-mass>
  <moldb-mono-mass type="decimal">887.065532</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>5289431</chemspider-id>
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  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM058772</chemdb-id>
  <dsstox-id>DTXSID20879790</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00013612</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>Naphthalenes</klass>
  <subklass>Naphthalene sulfonic acids and derivatives</subklass>
  <paper-count type="integer">147701</paper-count>
  <sync-id>CED0000829</sync-id>
  <structure-inchikey>DINKHUYGJKLNQS-UHFFFAOYSA-H</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T04:15:54Z</structure-indexed-at>
</compound>
