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<compound>
  <id type="integer">78186</id>
  <title nil="true"/>
  <common-name>Docosanamide, N-[2-[(2-cyanoethyl)[2-[(2-cyanoethyl)amino]ethyl]amino]ethyl]-</common-name>
  <description>Docosanamide, N-[2-[(2-cyanoethyl)[2-[(2-cyanoethyl)amino]ethyl]amino]ethyl]- belongs to the fatty amides, a subclass of fatty acyls within the organic compounds. It is categorized under the superclass of lipids and lipid-like molecules and has the formula C32H61N5O1. With an average molecular weight of 531.87 g/mol, Docosanamide, N-[2-[(2-cyanoethyl)[2-[(2-cyanoethyl)amino]ethyl]amino]ethyl]- is a heavy molecule.</description>
  <cas>68310-25-8</cas>
  <pubchem-id>110021</pubchem-id>
  <chemical-formula>C32H61N5O1</chemical-formula>
  <weight>531.9</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">2026-04-04T11:36:56Z</created-at>
  <updated-at type="dateTime">2026-08-31T18:56:42Z</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>CCCCCCCCCCCCCCCCCCCCCC(=O)NCCN(CCNCCC#N)CCC#N</moldb-smiles>
  <moldb-formula>C32H61N5O1</moldb-formula>
  <moldb-inchi>InChI=1S/C32H61N5O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-32(38)36-28-31-37(29-22-25-34)30-27-35-26-21-24-33/h35H,2-23,26-31H2,1H3,(H,36,38)</moldb-inchi>
  <moldb-inchikey>UUERCIFOWAZFFQ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">531.874</moldb-average-mass>
  <moldb-mono-mass type="decimal">531.487612</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>9.1</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>98818</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>CHEM074079</chemdb-id>
  <dsstox-id>DTXSID0071411</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00036537</susdat-id>
  <iupac>N-[2-[2-cyanoethyl-[2-(2-cyanoethylamino)ethyl]amino]ethyl]docosanamide</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>Lipids and lipid-like molecules</superklass>
  <klass>Fatty Acyls</klass>
  <subklass>Fatty amides</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0121465</sync-id>
  <structure-inchikey>UUERCIFOWAZFFQ-UHFFFAOYSA-N</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T04:25:42Z</structure-indexed-at>
</compound>
