
API0233487
Auranofin
Auranofin is an antirheumatic drug used for rheumatoid arthritis.
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CAS No.
34031-32-8
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Synonyms
AURANOFIN; Auranofina; Auranofine
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CHEMBL ID
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Indications
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Molecule Type
Small molecule
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Compound CID
16667669
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Molecular Weight (g/mol)
678.5
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Molecular Formula
C20H34AuO9PS
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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+;;/m1../s1
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InChIKey
AUJRCFUBUPVWSZ-XTZHGVARSA-M
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SMILES
CCP(CC)CC.CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)[S-])OC(=O)C)OC(=O)C)OC(=O)C.[Au+]
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IUPAC Name
gold(1+);(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxane-2-thiolate;triethylphosphane
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Exact Mass (Da)
678.132686
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Monoisotopic Mass (Da)
678.132686
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