103128 <common-name>1-Ethyl-4-[2-[5-isopropyl-3,8-dimethylazulen-1-yl]vinyl]quinolinium iodide</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>16206082</pubchem-id> <chemical-formula>C28H30N</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">2026-04-05T10:16:23Z</created-at> <updated-at type="dateTime">2026-04-05T10:16:23Z</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>[I-].CC[N+]1=CC=C(C=CC2=CC(C)=C3C=C(C=CC(C)=C23)C(C)C)C2=CC=CC=C12</moldb-smiles> <moldb-formula>C28H30N</moldb-formula> <moldb-inchi>InChI=1/C28H30N.HI/c1-6-29-16-15-22(25-9-7-8-10-27(25)29)13-14-24-17-21(5)26-18-23(19(2)3)12-11-20(4)28(24)26;/h7-19H,6H2,1-5H3;1H/q+1;/p-1</moldb-inchi> <moldb-inchikey>CGYUGPJPXYVQAN-IERUDJENSA-M</moldb-inchikey> <moldb-average-mass type="decimal">507.459</moldb-average-mass> <moldb-mono-mass type="decimal">380.237825</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <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>CHEM099021</chemdb-id> <dsstox-id>DTXSID30241181</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00066691</susdat-id> <iupac nil="true"/> <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>Lipids and lipid-like molecules</superklass> <klass>Prenol lipids</klass> <subklass>Sesquiterpenoids</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0173732</sync-id> <structure-inchikey>CGYUGPJPXYVQAN-UHFFFAOYSA-M</structure-inchikey> <structure-fingerprint>40000020000000000000800000000000002200000000001040000000000000000000001002000000000001008000000000000000000000000001800000000000000000100000004000000200000000000000000000000200000000000000000000001000000000001000000000180000000000000000000040000100001000000000000040000008800000000000000020001000100100000000000000000800000000000000000000040400080100000000000000000000000000000000000000000000040000000000000000000000000000100000002000001200000080000008000000000004000040000000000000200100000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ�������������������� ���€�5 ����ÿ��`�������`������`*�������@h�������@h�������@(�������h��������h�������@(������@h�������@(�������`������@(������@h�������@(������@h�������@h�������@(�������`������@(�������`�������`�������`������@(������@h�������@h�������@h�������@h�������@(��������������h���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">2026-09-19T04:40:49Z</structure-indexed-at> </compound>