63514 <common-name>8,8-Dimethyl-3-[(2-propylpentanoyl)oxy]-8-azoniabicyclo[3.2.1]octane</common-name> <description>8,8-Dimethyl-3-[(2-propylpentanoyl)oxy]-8-azoniabicyclo[3.2.1]octane belongs to the tropane alkaloids, a class of alkaloids and derivatives within the organic compounds. It has the chemical formula C17H32N1O2 and an average molecular weight of 282.45 g/mol.</description> <cas>6917-98-2</cas> <pubchem-id>4157</pubchem-id> <chemical-formula>C17H32N1O2</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">2026-04-03T01:07:47Z</created-at> <updated-at type="dateTime">2026-04-03T01:07:47Z</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>[H]C12CCC([H])(CC(C1)OC(=O)C(CCC)CCC)[N+]2(C)C</moldb-smiles> <moldb-formula>C17H32N1O2</moldb-formula> <moldb-inchi>InChI=1S/C17H32NO2/c1-5-7-13(8-6-2)17(19)20-16-11-14-9-10-15(12-16)18(14,3)4/h13-16H,5-12H2,1-4H3/q+1</moldb-inchi> <moldb-inchikey>XGGHHHBGPSNXFE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">282.447</moldb-average-mass> <moldb-mono-mass type="decimal">282.243304</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>10482228</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>CHEM059407</chemdb-id> <dsstox-id>DTXSID70274418</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00015372</susdat-id> <iupac>(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-propylpentanoate</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>Tropane alkaloids</klass> <subklass nil="true"/> <paper-count type="integer">0</paper-count> <sync-id>CED0083964</sync-id> <structure-inchikey>XGGHHHBGPSNXFE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000000100000010000040000000000004000000000000000002000000000400000000000000000000010000000000000000000000000000000000000000000000000000000020000000000100000000001000000000000020010000000000000000000000000000020000000000000800000000100000000040400020000000000220000000000000000000000000000000000000000802000004000000000000000000000001000000000000000000000000000000000000000000010000000000000000000000000000000000004000000000200000000080000000000004000000000400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAUAAAAFQAAAIABBgAwAAAAAQQGAGAAAAAC AgYAYAAAAAICBgAwAAAAAQQGAGAAAAACAgYAYAAAAAMBBgBgAAAAAgIIACgA AAADAgYAKAAAAAMECAAoAAAAAwIGAGAAAAADAQYAYAAAAAICBgBgAAAAAgIG AGAAAAABAwYAYAAAAAICBgBgAAAAAgIGAGAAAAABAwcgIgAAAAEEBgBgAAAA AQMGAGAAAAABAwsAAQABAgACAwADBAAEBQAFBgAFBwAHCCAICSgCCAoACgsA CwwADA0ACg4ADg8ADxAAAxEAERIAERMABgAAEQAAQgIAAAAFAQARAwIGBAUG ABEDFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:16:17Z</structure-indexed-at> </compound>