<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">348350</id>
  <title nil="true"/>
  <common-name>3-[4-[8-[4-(2,5-dioxopyrrolidin-3-yl)phenoxy]octoxy]phenyl]pyrrolidine-2,5-dione</common-name>
  <description>3-[4-[8-[4-(2,5-dioxopyrrolidin-3-yl)phenoxy]octoxy]phenyl]pyrrolidine-2,5-dione is a compound with the chemical formula C28H32N2O6. It has an average molecular weight of 492.60 g/mol.</description>
  <cas>87367-96-2</cas>
  <pubchem-id>3071139</pubchem-id>
  <chemical-formula>C28H32N2O6</chemical-formula>
  <weight>492.6</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">2026-08-31T12:20:29Z</created-at>
  <updated-at type="dateTime">2026-08-31T12:20:29Z</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>C1C(C(=O)NC1=O)C2=CC=C(C=C2)OCCCCCCCCOC3=CC=C(C=C3)C4CC(=O)NC4=O</moldb-smiles>
  <moldb-formula>C28H32N2O6</moldb-formula>
  <moldb-inchi>InChI=1S/C28H32N2O6/c31-25-17-23(27(33)29-25)19-7-11-21(12-8-19)35-15-5-3-1-2-4-6-16-36-22-13-9-20(10-14-22)24-18-26(32)30-28(24)34/h7-14,23-24H,1-6,15-18H2,(H,29,31,33)(H,30,32,34)</moldb-inchi>
  <moldb-inchikey>RSDLTRYZMRTUDB-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">492.2260367</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.5</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>CHEM344243</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>3-[4-[8-[4-(2,5-dioxopyrrolidin-3-yl)phenoxy]octoxy]phenyl]pyrrolidine-2,5-dione</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>Organoheterocyclic compounds</superklass>
  <klass>Pyrrolidines</klass>
  <subklass>Phenylpyrrolidines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0298685</sync-id>
  <structure-inchikey>RSDLTRYZMRTUDB-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000800002000000000000000000000400008000010000000000000000000020200000000000000000000000000000000000000000000000000004000000000000000000000000000022002000000100000200000000001000000000000000000000000000000000000000020000000000000000000000100020000008000000000000200000010000000000000000000000000040000001000000000000000000000000080000000000000000080000000000000000000000000000110000000000000000000000000000000000000000000200000000000010000000000000000040000000010000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������$���'���€���`�������`�������(�������(�������h��������(�������(������@(������@h�������@h�������@(������@h�������@h��������(�������`�������`�������`�������`�������`�������`�������`�������`�������(������@(������@h�������@h�������@(������@h�������@h��������`�������`�������(�������(�������h��������(�������(��������������(��� �� ��(������h��	h�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:46:45Z</structure-indexed-at>
</compound>
