<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">351994</id>
  <title nil="true"/>
  <common-name>4-hydroxy-7-[[5-hydroxy-6-[(2-hydroxy-5-sulfamoylphenyl)diazenyl]-7-sulfonaphthalen-2-yl]amino]-3-[(2-hydroxy-5-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonic acid</common-name>
  <description>4-hydroxy-7-[[5-hydroxy-6-[(2-hydroxy-5-sulfamoylphenyl)diazenyl]-7-sulfonaphthalen-2-yl]amino]-3-[(2-hydroxy-5-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonic acid has the chemical formula C32H25N7O14S4. With an average molecular weight of 859.80 g/mol, 4-hydroxy-7-[[5-hydroxy-6-[(2-hydroxy-5-sulfamoylphenyl)diazenyl]-7-sulfonaphthalen-2-yl]amino]-3-[(2-hydroxy-5-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonic acid is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>81254</pubchem-id>
  <chemical-formula>C32H25N7O14S4</chemical-formula>
  <weight>859.8</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">2026-08-31T18:03:40Z</created-at>
  <updated-at type="dateTime">2026-08-31T18:03:40Z</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=CC2=C(C(=C(C=C2C=C1NC3=CC4=CC(=C(C(=C4C=C3)O)N=NC5=C(C=CC(=C5)S(=O)(=O)N)O)S(=O)(=O)O)S(=O)(=O)O)N=NC6=C(C=CC(=C6)S(=O)(=O)N)O)O</moldb-smiles>
  <moldb-formula>C32H25N7O14S4</moldb-formula>
  <moldb-inchi>InChI=1S/C32H25N7O14S4/c33-54(44,45)19-3-7-25(40)23(13-19)36-38-29-27(56(48,49)50)11-15-9-17(1-5-21(15)31(29)42)35-18-2-6-22-16(10-18)12-28(57(51,52)53)30(32(22)43)39-37-24-14-20(55(34,46)47)4-8-26(24)41/h1-14,35,40-43H,(H2,33,44,45)(H2,34,46,47)(H,48,49,50)(H,51,52,53)</moldb-inchi>
  <moldb-inchikey>CWGBFNHQYQIHRP-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">859.0342332</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.7</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>CHEM347887</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>4-hydroxy-7-[[5-hydroxy-6-[(2-hydroxy-5-sulfamoylphenyl)diazenyl]-7-sulfonaphthalen-2-yl]amino]-3-[(2-hydroxy-5-sulfamoylphenyl)diazenyl]naphthalene-2-sulfonic acid</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>Naphthalenes</klass>
  <subklass>Naphthalene sulfonic acids and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0302284</sync-id>
  <structure-inchikey>CWGBFNHQYQIHRP-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>2000000000000000000000000000000000000000000180200000000000000000000000000001004000024000000000800000000000000000000000100000000000000000000000008000002020000020000000000000001004000000000000000000010000004810000000100000000000001000000400000000000000000000000000000000000000000000000080001000000400000000000000008000000000000000000800040000080000000100000000000000180001400000000020040000080200002100000000000000400000000000000004000200000000000000000000000801000040000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAA5AAAAPgAAAIABBkBoAAAAAwMBBkBoAAAA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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:49:50Z</structure-indexed-at>
</compound>
