351832 <common-name>(2s,3s,5s,8r,9s,10s,13s,14s,16s,17r)-10,13-dimethyl-2,17-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthrene-3,16-diol</common-name> <description>(2s,3s,5s,8r,9s,10s,13s,14s,16s,17r)-10,13-dimethyl-2,17-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthrene-3,16-diol is a compound with the formula C31H56N2O2+2. It has an average molecular weight of 488.80 g/mol.</description> <cas nil="true"/> <pubchem-id>3039426</pubchem-id> <chemical-formula>C31H56N2O2+2</chemical-formula> <weight>488.8</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">2026-08-31T17:47:05Z</created-at> <updated-at type="dateTime">2026-08-31T17:47:05Z</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>CC12CCC3C(C1CC(C2[N+]4(CCCCC4)C)O)CCC5C3(CC(C(C5)O)[N+]6(CCCCC6)C)C</moldb-smiles> <moldb-formula>C31H56N2O2+2</moldb-formula> <moldb-inchi>InChI=1S/C31H56N2O2/c1-30-14-13-24-23(25(30)20-28(35)29(30)33(4)17-9-6-10-18-33)12-11-22-19-27(34)26(21-31(22,24)2)32(3)15-7-5-8-16-32/h22-29,34-35H,5-21H2,1-4H3/q+2/t22-,23+,24-,25-,26-,27-,28-,29-,30-,31-/m0/s1</moldb-inchi> <moldb-inchikey>PUVMYYBNVPGZKM-OBIZLECESA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">488.434179</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.4</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>CHEM347725</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>(2s,3s,5s,8r,9s,10s,13s,14s,16s,17r)-10,13-dimethyl-2,17-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthrene-3,16-diol</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>Steroids and steroid derivatives</klass> <subklass>Androstane steroids</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0302130</sync-id> <structure-inchikey>PUVMYYBNVPGZKM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200000000000000000000000004000000000000000000010000000000000000000000000000800000000000000000000000000000020000000000000000000000120c0000000002020000000000200000000000001000000000000000000000000000000010000000000400000000000000000020000000000000000010000100800000048000000010000000000000000200000000000000000000000400020000800000004000048000000000000001008000000000000040000000000000000000000000000010000000200020000000000020000000000044000000000001001000000000000000000000000000100000001000000180000000080000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ����������������#���(���€���`������� ������`�������`�������`�������`�������`�������`�������`�������`������ "�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`������ "�������`�������`�������`�������`�������`�������`�������`������������������������������� � � ������ � ����� ������������������������������������������������ ��!��"���� ������ ���� ��B��������������� ���� �� ������������������� �����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:49:42Z</structure-indexed-at> </compound>