328994 <common-name>[4-(2,5-dimethoxyphenyl)-4-hydroxy-4-phenylbutan-2-yl]-trimethylazanium</common-name> <description>[4-(2,5-dimethoxyphenyl)-4-hydroxy-4-phenylbutan-2-yl]-trimethylazanium is a compound with the formula C21H30NO3+. It has an average molecular weight of 344.50 g/mol.</description> <cas nil="true"/> <pubchem-id>14192</pubchem-id> <chemical-formula>C21H30NO3+</chemical-formula> <weight>344.5</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">2026-08-30T09:04:47Z</created-at> <updated-at type="dateTime">2026-08-30T09:04:47Z</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>CC(CC(C1=CC=CC=C1)(C2=C(C=CC(=C2)OC)OC)O)[N+](C)(C)C</moldb-smiles> <moldb-formula>C21H30NO3+</moldb-formula> <moldb-inchi>InChI=1S/C21H30NO3/c1-16(22(2,3)4)15-21(23,17-10-8-7-9-11-17)19-14-18(24-5)12-13-20(19)25-6/h7-14,16,23H,15H2,1-6H3/q+1</moldb-inchi> <moldb-inchikey>PJWOTFYKAKDPKV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">344.2225688</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.3</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>CHEM324887</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>[4-(2,5-dimethoxyphenyl)-4-hydroxy-4-phenylbutan-2-yl]-trimethylazanium</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Diphenylmethanes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0279567</sync-id> <structure-inchikey>PJWOTFYKAKDPKV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40028000000000000000800200002000000000000000000040000000000000400000001000000000200000000108000004000002100000000000000000000000000000000000000000000000000008000000000100000100000200000000000000040000010000400040008000100000000000000000000000000000000000000000000042000000800000000000000000000000000100000000000002000000000000000200000000000000080000000040000000000000000000000000000080000000000000000000000000000000000000000000000000000200000000000000000000000000000040000000080000000000000028000002000040000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`������� �����@(������@h�������@h�������@h�������@h�������@h�������@(������@(������@h�������@h�������@(������@h��������(�������`�������(�������`�������`������ "�������`�������`�������`��������������������h���h���h���h�� h�� � �h���h�� h� �h���h��� ����� ������������������ �h�� h�B��������� ���� �� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:31:55Z</structure-indexed-at> </compound>