<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">359462</id>
  <title nil="true"/>
  <common-name>N-(6-benzamido-8,15,31,38-tetraoxo-18,28-diazadodecacyclo[22.21.1.03,19.04,17.07,16.09,14.020,46.025,45.027,43.029,42.030,39.032,37]hexatetraconta-1(46),2,4,6,9,11,13,16,19,21,23,25(45),26,29,32,34,36,39,41,43-icosaen-40-yl)benzamide</common-name>
  <description>N-(6-benzamido-8,15,31,38-tetraoxo-18,28-diazadodecacyclo[22.21.1.03,19.04,17.07,16.09,14.020,46.025,45.027,43.029,42.030,39.032,37]hexatetraconta-1(46),2,4,6,9,11,13,16,19,21,23,25(45),26,29,32,34,36,39,41,43-icosaen-40-yl)benzamide is a chemical compound with the formula C58H30N4O6. With an average molecular weight of 878.90 g/mol, N-(6-benzamido-8,15,31,38-tetraoxo-18,28-diazadodecacyclo[22.21.1.03,19.04,17.07,16.09,14.020,46.025,45.027,43.029,42.030,39.032,37]hexatetraconta-1(46),2,4,6,9,11,13,16,19,21,23,25(45),26,29,32,34,36,39,41,43-icosaen-40-yl)benzamide is a heavy molecule.</description>
  <cas>97337-97-8</cas>
  <pubchem-id>57357056</pubchem-id>
  <chemical-formula>C58H30N4O6</chemical-formula>
  <weight>878.9</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">2026-09-01T07:34:46Z</created-at>
  <updated-at type="dateTime">2026-09-01T07:34:46Z</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=C(C=C1)C(=O)NC2=C3C(=C4C(=C2)C5=CC6=C(C=C5N4)C7=CC=CC8=C9C(=CC6=C87)C1=CC(=C2C(=C1N9)C(=O)C1=CC=CC=C1C2=O)NC(=O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1C3=O</moldb-smiles>
  <moldb-formula>C58H30N4O6</moldb-formula>
  <moldb-inchi>InChI=1S/C58H30N4O6/c63-53-30-16-7-9-18-32(30)55(65)48-46(53)43(60-57(67)27-12-3-1-4-13-27)25-40-37-22-35-36(24-42(37)59-51(40)48)29-20-11-21-34-45(29)38(35)23-39-41-26-44(61-58(68)28-14-5-2-6-15-28)47-49(52(41)62-50(34)39)56(66)33-19-10-8-17-31(33)54(47)64/h1-26,59,62H,(H,60,67)(H,61,68)</moldb-inchi>
  <moldb-inchikey>ZAFIQEQELBZEOE-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">878.2165347</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>12.1</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>CHEM355355</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>N-(6-benzamido-8,15,31,38-tetraoxo-18,28-diazadodecacyclo[22.21.1.03,19.04,17.07,16.09,14.020,46.025,45.027,43.029,42.030,39.032,37]hexatetraconta-1(46),2,4,6,9,11,13,16,19,21,23,25(45),26,29,32,34,36,39,41,43-icosaen-40-yl)benzamide</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>Anthracenes</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0309674</sync-id>
  <structure-inchikey>ZAFIQEQELBZEOE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000800000000000000000010000000000000000000000000100000000000000000000002040000020800000000400000000000000000000000200000000000000000000000000000000000000002000000000000000000000000000080000000001000000000000000010080000000000000010000004008000000000000100000000000080000021000000008000000000018000008000000000000000000000000000000004000008400000000008000000004008000000000000200000000044000000000000000000420040000000000000000000d20000000002100000800010000000004000000000040000000000000000c000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������D���Q���€��@h�������@h�������@h�������@(������@h�������@h��������(�������(�������h�������@(������@(������@(������@(������@(������@h�������@(������@h�������@(������@(������@h�������@(������@8�������@(������@h�������@h�������@h�������@(������@(������@(������@h�������@(������@(������@(������@h�������@(������@(������@(������@(������@8��������(�������(������@(������@h�������@h�������@h�������@h�������@(�������(�������(�������h��������(�������(������@(������@h�������@h�������@h�������@h�������@h��������(�������(������@(������@h�������@h�������@h�������@h�������@(�������(�������(��������h���h���h���h���h��� ��(��� �	 	
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��=&gt;?@A&lt;����������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:56:58Z</structure-indexed-at>
</compound>
