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  <id type="integer">141906</id>
  <title nil="true"/>
  <common-name>Bendacort</common-name>
  <description>Bendacort belongs to the pregnane steroids, a subclass of steroids and steroid derivatives within the organic compounds. It has the chemical formula C37H42N2O7. With an average molecular weight of 626.75 g/mol, Bendacort is a heavy molecule. It is further classified as part of the lipids and lipid-like molecules superclass.</description>
  <cas>53716-43-1</cas>
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  <chemical-formula>C37H42N2O7</chemical-formula>
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  <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">2026-04-15T18:21:19Z</created-at>
  <updated-at type="dateTime">2026-05-14T20:50:34Z</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>DB21760</drugbank-id>
  <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>[H][C@@]12CC[C@](O)(C(=O)COC(=O)COC3=NN(CC4=CC=CC=C4)C4=CC=CC=C34)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C</moldb-smiles>
  <moldb-formula>C37H42N2O7</moldb-formula>
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  <moldb-inchikey>DYVIEGCPUPGXOH-HGGPGNIHSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">626.75</moldb-average-mass>
  <moldb-mono-mass type="decimal">626.2992017</moldb-mono-mass>
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  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM137799</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 nil="true"/>
  <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>Steroids and steroid derivatives</klass>
  <subklass>Pregnane steroids</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0110058</sync-id>
  <structure-inchikey>DYVIEGCPUPGXOH-HGGPGNIHSA-N</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T04:52:34Z</structure-indexed-at>
</compound>
