1.0 2016-05-22 03:23:54 UTC 2026-05-14 16:55:16 UTC Auranofin SmallMolecule Auranofin is a chemical compound with the molecular formula C20H34AuO9PS. Auranofin belongs to the tetracarboxylic acids and derivatives, a subclass of carboxylic acids and derivatives within the organic compounds. With an average molecular weight of 678.48 g/mol, Auranofin is a heavy molecule. This compound is found in or released from one recorded source: healthcare, pharmaceuticals, and veterinary products, specifically antiinflammatory and antirheumatic products. The recorded route of exposure for this substance is oral. Auranofin acts on five recorded protein targets, serving as an inhibitor or modulator of the Inhibitor of nuclear factor kappa-B kinase subunit beta (IKBKB), Peroxiredoxin-5, mitochondrial (PRDX5), Steroid hormone receptor ERR1 (ESRRA), and Steroid hormone receptor ERR2 (ESRRB), as well as one other protein. C20H34AuO9PS 678.48 678.132685 gold(1+) ion [(2R,3S,4R,5S,6S)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]sulfanide triethylphosphane gold(1+) ion [(2R,3S,4R,5S,6S)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]sulfanide triethylphosphine 34031-32-8 [Au+].CCP(CC)CC.[H][C@]1([S-])O[C@@]([H])(COC(C)=O)[C@]([H])(OC(C)=O)[C@@]([H])(OC(C)=O)[C@]1([H])OC(C)=O InChI=1S/C14H20O9S.C6H15P.Au/c1-6(15)19-5-10-11(20-7(2)16)12(21-8(3)17)13(14(24)23-10)22-9(4)18;1-4-7(5-2)6-3;/h10-14,24H,5H2,1-4H3;4-6H2,1-3H3;/q;;+1/p-1/t10-,11-,12+,13-,14+;;/m0../s1 AUJRCFUBUPVWSZ-PTNXSCMHSA-M Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Tetracarboxylic acids and derivatives Tetracarboxylic acids and derivatives Carbonyl compounds Carboxylic acid esters Hydrocarbon derivatives Monosaccharides Organic oxides Organic transition metal salts Organophosphorus compounds Organopnictogen compounds Oxacyclic compounds Oxanes Sulfenyl compounds Aliphatic heteromonocyclic compound Carbonyl group Carboxylic acid ester Hydrocarbon derivative Monosaccharide Organic metal salt Organic oxide Organic oxygen compound Organic salt Organic transition metal salt Organoheterocyclic compound Organooxygen compound Organophosphorus compound Organopnictogen compound Organosulfur compound Oxacycle Oxane Sulfenyl compound Tetracarboxylic acid or derivatives Aliphatic heteromonocyclic compounds Detected and Not Quantified logp -1 logp 0.65 ALOGPS logs -1.98 ALOGPS solubility 5.85e+00 g/l ALOGPS logp -0.2 ChemAxon pka_strongest_acidic 8.63 ChemAxon pka_strongest_basic -4.3 ChemAxon iupac gold(1+) ion [(2R,3S,4R,5S,6S)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]sulfanide triethylphosphane ChemAxon average_mass 678.48 ChemAxon mono_mass 678.132685 ChemAxon smiles [Au+].CCP(CC)CC.[H][C@]1([S-])O[C@@]([H])(COC(C)=O)[C@]([H])(OC(C)=O)[C@@]([H])(OC(C)=O)[C@]1([H])OC(C)=O ChemAxon formula C20H34AuO9PS ChemAxon inchi InChI=1S/C14H20O9S.C6H15P.Au/c1-6(15)19-5-10-11(20-7(2)16)12(21-8(3)17)13(14(24)23-10)22-9(4)18;1-4-7(5-2)6-3;/h10-14,24H,5H2,1-4H3;4-6H2,1-3H3;/q;;+1/p-1/t10-,11-,12+,13-,14+;;/m0../s1 ChemAxon inchikey AUJRCFUBUPVWSZ-PTNXSCMHSA-M ChemAxon polar_surface_area 114.43 ChemAxon refractivity 79.49 ChemAxon polarizability 34.64 ChemAxon rotatable_bond_count 12 ChemAxon acceptor_count 5 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f72441b7bd8> DB00995 BE0001154 BE0000907 BE0003722 BE0005001 BE0002088