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  <id type="integer">19771</id>
  <title nil="true"/>
  <common-name>Cepharanthine</common-name>
  <description>Cepharanthine belongs to the lignans, neolignans and related compounds, a superclass within the organic compounds. It has the chemical formula C37H38N2O6. With an average molecular weight of 606.72 g/mol, Cepharanthine is a heavy molecule.</description>
  <cas>481-49-2</cas>
  <pubchem-id>10206</pubchem-id>
  <chemical-formula>C37H38N2O6</chemical-formula>
  <weight nil="true"/>
  <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">2016-05-22T05:25:42Z</created-at>
  <updated-at type="dateTime">2026-05-14T19:59:31Z</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>DB16824</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@]12CC3=CC(OC4=CC=C(C[C@]5([H])N(C)CCC6=CC7=C(OCO7)C(OC7=C(OC)C=C(CCN1C)C2=C7)=C56)C=C4)=C(OC)C=C3</moldb-smiles>
  <moldb-formula>C37H38N2O6</moldb-formula>
  <moldb-inchi>InChI=1S/C37H38N2O6/c1-38-13-11-24-18-31(41-4)33-20-27(24)28(38)16-23-7-10-30(40-3)32(17-23)44-26-8-5-22(6-9-26)15-29-35-25(12-14-39(29)2)19-34-36(37(35)45-33)43-21-42-34/h5-10,17-20,28-29H,11-16,21H2,1-4H3/t28-,29+/m1/s1</moldb-inchi>
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  <moldb-average-mass type="decimal">606.719</moldb-average-mass>
  <moldb-mono-mass type="decimal">606.272986952</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>6.42</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
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  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM018666</chemdb-id>
  <dsstox-id>DTXSID6045957</dsstox-id>
  <toxcast-id>45957</toxcast-id>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>(14S,27R)-22,33-dimethoxy-13,28-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.2^{16,19}.1^{3,10}.1^{21,25}.0^{4,8}.0^{31,35}.0^{14,39}]nonatriaconta-1(34),3,8,10(39),16,18,21,23,25(36),31(35),32,37-dodecaene</iupac>
  <moldb-polar-surface-area>61.860000000000014</moldb-polar-surface-area>
  <moldb-refractivity>172.95509999999996</moldb-refractivity>
  <moldb-polarizability>65.7914965808383</moldb-polarizability>
  <moldb-rotatable-bond-count>2</moldb-rotatable-bond-count>
  <moldb-acceptor-count>6</moldb-acceptor-count>
  <moldb-donor-count>0</moldb-donor-count>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic>8.316392377787107</moldb-pka-strongest-basic>
  <moldb-physiological-charge>2</moldb-physiological-charge>
  <moldb-number-of-rings>8</moldb-number-of-rings>
  <moldb-alogps-logp>5.31</moldb-alogps-logp>
  <moldb-alogps-logs>-5.10</moldb-alogps-logs>
  <moldb-alogps-solubility>4.83e-03 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Lignans, neolignans and related compounds</superklass>
  <klass nil="true"/>
  <subklass nil="true"/>
  <paper-count type="integer">574</paper-count>
  <sync-id>CED0006629</sync-id>
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  <structure-indexed-at type="dateTime">2026-09-19T04:07:47Z</structure-indexed-at>
</compound>
