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<compound>
  <id type="integer">356043</id>
  <title nil="true"/>
  <common-name>1-[(1r)-1-[[(2r,3r,11bs)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1h-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1h-isoquinolin-2-yl]-3-(dipentylamino)propan-2-ol</common-name>
  <description>1-[(1r)-1-[[(2r,3r,11bs)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1h-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1h-isoquinolin-2-yl]-3-(dipentylamino)propan-2-ol is a compound with the formula C42H67N3O5. With an average molecular weight of 694.00 g/mol, 1-[(1r)-1-[[(2r,3r,11bs)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1h-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1h-isoquinolin-2-yl]-3-(dipentylamino)propan-2-ol is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>3035170</pubchem-id>
  <chemical-formula>C42H67N3O5</chemical-formula>
  <weight>694</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">2026-09-01T01:10:24Z</created-at>
  <updated-at type="dateTime">2026-09-01T01:10:24Z</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>CCCCCN(CCCCC)CC(CN1CCC2=CC(=C(C=C2C1CC3CC4C5=CC(=C(C=C5CCN4CC3CC)OC)OC)OC)OC)O</moldb-smiles>
  <moldb-formula>C42H67N3O5</moldb-formula>
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  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">693.5080723</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>8.2</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
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  <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>CHEM351936</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>1-[(1r)-1-[[(2r,3r,11bs)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1h-benzo[a]quinolizin-2-yl]methyl]-6,7-dimethoxy-3,4-dihydro-1h-isoquinolin-2-yl]-3-(dipentylamino)propan-2-ol</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>Alkaloids and derivatives</superklass>
  <klass>Emetine alkaloids</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0306293</sync-id>
  <structure-inchikey>MRZGTNKJSBWWRW-UHFFFAOYSA-N</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T05:53:54Z</structure-indexed-at>
</compound>
