337048 <common-name>2-(1-methyl-1-prop-2-enylpyrrolidin-1-ium-2-yl)-1,3-diphenylpropan-2-ol</common-name> <description>2-(1-methyl-1-prop-2-enylpyrrolidin-1-ium-2-yl)-1,3-diphenylpropan-2-ol is a compound with the formula C23H30NO+. It has an average molecular weight of 336.50 g/mol.</description> <cas nil="true"/> <pubchem-id>3061842</pubchem-id> <chemical-formula>C23H30NO+</chemical-formula> <weight>336.5</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">2026-08-30T19:45:08Z</created-at> <updated-at type="dateTime">2026-08-30T19:45:08Z</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>C[N+]1(CCCC1C(CC2=CC=CC=C2)(CC3=CC=CC=C3)O)CC=C</moldb-smiles> <moldb-formula>C23H30NO+</moldb-formula> <moldb-inchi>InChI=1S/C23H30NO/c1-3-16-24(2)17-10-15-22(24)23(25,18-20-11-6-4-7-12-20)19-21-13-8-5-9-14-21/h3-9,11-14,22,25H,1,10,15-19H2,2H3/q+1</moldb-inchi> <moldb-inchikey>FCWDQWJASHQNEV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">336.2327396</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.6</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>CHEM332941</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>2-(1-methyl-1-prop-2-enylpyrrolidin-1-ium-2-yl)-1,3-diphenylpropan-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>Phenylpropanoids and polyketides</superklass> <klass>Linear 1,3-diarylpropanoids</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0287496</sync-id> <structure-inchikey>FCWDQWJASHQNEV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000002000000000000000000000000000000000000000000000000000000000000000000004000000002080000040000400000000000000000000100000000000000000000000000000000200000000000000000000000000010000000800000000000080000000020008000000100000000000100800000040200000800000010000000000000010000100000000000080000000000000000004000000000200080000000000000000000000000000000000000000000000000000010000000000042000010000000000000000004220000000004000000008000000002040000000080000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAZAAAAGwAAAIABBgBgAAAAAQMHICIAAAAB BAYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAMBBgAgAAAABAYAYAAA AAICBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEGQGgAAAAD AwEGQGgAAAADAwEGAGAAAAACAgZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMB BkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBCABgAAAAAQEGAGAAAAACAgYA aAAAAAMDAQYAaAAAAAMCAgsAAQABAgACAwADBAAEBQAFBgAGBwAHCAAICWgM CQpoDAoLaAwLDGgMDA1oDAYOAA4PAA8QaAwQEWgMERJoDBITaAwTFGgMBhUA ARYAFhcAFxgIAgUBAA0IaAwUD2gMQgMAAAAFAQIDBAUGCQoLDA0IBhAREhMU DxcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:38:16Z</structure-indexed-at> </compound>