350751 <common-name>5-[(1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl)methylsulfamoyl]-1-hydroxynaphthalene-2-diazonium</common-name> <description>5-[(1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl)methylsulfamoyl]-1-hydroxynaphthalene-2-diazonium is a chemical compound with the formula C30H36N3O3S+. With an average molecular weight of 518.70 g/mol, 5-[(1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl)methylsulfamoyl]-1-hydroxynaphthalene-2-diazonium is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>169351</pubchem-id> <chemical-formula>C30H36N3O3S+</chemical-formula> <weight>518.7</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">2026-08-31T16:00:43Z</created-at> <updated-at type="dateTime">2026-08-31T16:00:43Z</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(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CNS(=O)(=O)C4=CC=CC5=C4C=CC(=C5O)[N+]#N)C</moldb-smiles> <moldb-formula>C30H36N3O3S+</moldb-formula> <moldb-inchi>InChI=1S/C30H35N3O3S/c1-19(2)20-9-12-24-21(17-20)10-14-27-29(3,15-6-16-30(24,27)4)18-32-37(35,36)26-8-5-7-23-22(26)11-13-25(33-31)28(23)34/h5,7-9,11-13,17,19,27,32H,6,10,14-16,18H2,1-4H3/p+1</moldb-inchi> <moldb-inchikey>BTFYPVCINZKBAG-UHFFFAOYSA-O</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">518.2477382</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>9.1</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>CHEM346644</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>5-[(1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl)methylsulfamoyl]-1-hydroxynaphthalene-2-diazonium</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>Lipids and lipid-like molecules</superklass> <klass>Prenol lipids</klass> <subklass>Diterpenoids</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0301055</sync-id> <structure-inchikey>BTFYPVCINZKBAG-UHFFFAOYSA-O</structure-inchikey> <structure-fingerprint>40000000000000004000880000800000000010000080000000200000000000000000001080000200000000020000000000800000000000000000040201000200000000000000000001000200000000000420000200000020004000000000000000200000010000000000044000100200000000020000004000000000800000100801000048000000800000000000000082200000000000000000080000000020000000000004000000041400088000000000000000000000080000100000010000000010040000002000002000000000000000000000000104200200000000800008000000000004000040080000000000200000000000080000000000080000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAlAAAAKQAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAEDBkAoAAAAAwQGQGgAAAADAwEGQCgAAAADBAZAKAAAAAMEBkBo AAAAAwMBBkBoAAAAAwMBBgAgAAAABAYAYAAAAAICBgBgAAAAAgIGAGAAAAAC AgYAIAAAAAQGAGAAAAADAQYAYAAAAAICBgBgAAAAAgIGAGAAAAABAwYAYAAA AAICBwBgAAAAAgEQACAAAAAGCAAoAAAAAwIIACgAAAADAgZAKAAAAAMEBkBo AAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkAoAAAAAwQGQCgAAAADBAZAaAAA AAMDAQZAaAAAAAMDAQZAKAAAAAMEBkAoAAAAAwQIAGgAAAADAQEHICoAAAAB AgQHACgAAAACAwYAYAAAAAEDCwABAAECAAEDAAMEaAwEBWgMBQZoDAYHaAwH CGgMBgkACQoACgsACwwADA0ADQ4ADg8ADxAADREADRIAEhMAExQAFBUIAhQW CAIUFwAXGGgMGBloDBkaaAwaG2gMGxxoDBwdaAwdHmgMHh9oDB8gaAwgISAf IiAiIygDCSQACANoDBAFAA4JABwXaAwgG2gMQgUAAAAGAwgHBgUEBgoLDA0O CQYPEAUGCQ4GGBkaGxwXBh0eHyAbHBcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:48:44Z</structure-indexed-at> </compound>