333667 <common-name>Methyl 1-[2-[2-(3-methoxycarbonyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethoxy]ethyl]-1-azoniabicyclo[2.2.2]octane-3-carboxylate</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>113794</pubchem-id> <chemical-formula>C22H38N2O5+2</chemical-formula> <weight>410.5</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">2026-08-30T15:11:17Z</created-at> <updated-at type="dateTime">2026-08-30T15:11:17Z</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>COC(=O)C1C[N+]2(CCC1CC2)CCOCC[N+]34CCC(CC3)C(C4)C(=O)OC</moldb-smiles> <moldb-formula>C22H38N2O5+2</moldb-formula> <moldb-inchi>InChI=1S/C22H38N2O5/c1-27-21(25)19-15-23(7-3-17(19)4-8-23)11-13-29-14-12-24-9-5-18(6-10-24)20(16-24)22(26)28-2/h17-20H,3-16H2,1-2H3/q+2</moldb-inchi> <moldb-inchikey>HQWLINBOESCVJJ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">410.2780723</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.9</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>CHEM329560</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>Methyl 1-[2-[2-(3-methoxycarbonyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethoxy]ethyl]-1-azoniabicyclo[2.2.2]octane-3-carboxylate</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>Organoheterocyclic compounds</superklass> <klass>Piperidines</klass> <subklass>Piperidinecarboxylic acids and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0284147</sync-id> <structure-inchikey>HQWLINBOESCVJJ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000002000000000800000000000000000000000200000004000000000000000000000000000000000000000000000000000002000000000000000000000000002000000000000400000000200000024000000001100000000000000000000000000010000000040000000000000000000021000000000000000000000100001000040000000000000000012000080000000000000000000000000000000000000000804000000000000000000000000000000000001000000000000000000000000000000010000000000000000000000000000000000000000000000000000000000000000000000000000000400000000008440000080000000000000</structure-fingerprint> 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�������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:35:42Z</structure-indexed-at> </compound>