<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">362647</id>
  <title nil="true"/>
  <common-name>Dibenzyl 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylcarbamoyl]tridec-4-enedioate</common-name>
  <description>Dibenzyl 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylcarbamoyl]tridec-4-enedioate has the chemical formula C83H138N2O33. With an average molecular weight of 1,692 g/mol, Dibenzyl 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylcarbamoyl]tridec-4-enedioate is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>168266380</pubchem-id>
  <chemical-formula>C83H138N2O33</chemical-formula>
  <weight>1692</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">2026-09-01T12:00:34Z</created-at>
  <updated-at type="dateTime">2026-09-01T12:00:34Z</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>C1CC(=O)N(C1=O)OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)C(CC=CCCCCCCCC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3</moldb-smiles>
  <moldb-formula>C83H138N2O33</moldb-formula>
  <moldb-inchi>InChI=1S/C83H138N2O33/c86-78-21-22-79(87)85(78)118-81(89)23-25-92-27-29-94-31-33-96-35-37-98-39-41-100-43-45-102-47-49-104-51-53-106-55-57-108-59-61-110-63-65-112-67-69-114-71-72-115-70-68-113-66-64-111-62-60-109-58-56-107-54-52-105-50-48-103-46-44-101-42-40-99-38-36-97-34-32-95-30-28-93-26-24-84-82(90)77(83(91)117-74-76-17-11-8-12-18-76)19-13-5-3-1-2-4-6-14-20-80(88)116-73-75-15-9-7-10-16-75/h5,7-13,15-18,77H,1-4,6,14,19-74H2,(H,84,90)</moldb-inchi>
  <moldb-inchikey>ANZPMUQTSYJXOF-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">1690.918185</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.6</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>CHEM358540</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>Dibenzyl 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylcarbamoyl]tridec-4-enedioate</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>Benzene and substituted derivatives</klass>
  <subklass>Benzyloxycarbonyls</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0312708</sync-id>
  <structure-inchikey>ANZPMUQTSYJXOF-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40040000400000060000800000000000000010000000000004000000000000000000000020000020000000000008000004004000000000400000000000000000000000000000002400000000000004002020001104001300000000000040000081000002010000000100000000000000400000020100000000000000000000020000000000200000800000000000010084000000000100001010000000001000000000000000000000080000082009000000000080000000000200000000000200000008000000000000000000004000000000000000000000200230000000020000000000000000000040000000012400000000000000000080000000000020</structure-fingerprint>
  <structure-pattern-fingerprint>553484a00536ee50c9e41b4083b8b282081115b0811520e0053f62748334a84c644641d41184a048c701516881c010001ce20bb4e08d72350365757992eb4002c6110c419b901440129013e200720341284445c051611bb3515e4467441149934cb8052f28480231610c4400d5f4024460cca0d20305e524b11902e243d15a8270c40a180ef0824a3e170250c92e06493b1c1a724d419f8a700408a5604486c4004731130890e33008c40d60077e35114ad008c0a9450a50f8050a30c8e00a12b10100a415d9513247c04446741342ba08150d0022207062cd607a0c4c01430492304d9298831b19134c0441dc12a08a40541230e2c2048f10039c825a180b07</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAB2AAAAeAAAAIABBgBgAAAAAgIGAGAAAAAC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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:59:36Z</structure-indexed-at>
</compound>
