<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">66592</id>
  <title nil="true"/>
  <common-name>Direct Red 23</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id nil="true"/>
  <chemical-formula>C35H27N7O7S1</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">2026-04-03T06:53:47Z</created-at>
  <updated-at type="dateTime">2026-04-03T06:53:47Z</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+].CC(=O)NC1=CC=C(C=C1)N=NC1=C(C=C2C=C(NC(=O)NC3=CC4=CC(=C(N=NC5=CC=CC=C5)C(O)=C4C=C3)S([O-])(=O)=O)C=CC2=C1O)S([O-])(=O)=O</moldb-smiles>
  <moldb-formula>C35H27N7O7S1</moldb-formula>
  <moldb-inchi>InChI=1S/C35H27N7O7S/c1-20(43)36-23-8-10-25(11-9-23)40-42-32-31(50(47,48)49)19-22-18-27(13-15-29(22)34(32)45)38-35(46)37-26-12-14-28-21(17-26)7-16-30(33(28)44)41-39-24-5-3-2-4-6-24/h2-19,44-45H,1H3,(H,36,43)(H2,37,38,46)(H,47,48,49)/b41-39+,42-40?</moldb-inchi>
  <moldb-inchikey>NLMHXPDMNXMQBY-KWQKICJSSA-L</moldb-inchikey>
  <moldb-average-mass type="decimal">813.72</moldb-average-mass>
  <moldb-mono-mass type="decimal">689.169267</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>7844597</chemspider-id>
  <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>CHEM062485</chemdb-id>
  <dsstox-id>DTXSID90879787</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00019521</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"/>
</compound>
