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Tauroursodeoxycholic Acid Sodium Salt (90%)

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For Research Use Only | Not For Clinical Use
CATAPS35807853
CAS35807-85-3
Structure
SynonymsSodium tauroursodeoxycholate, Sodium tauroursodesoxycholate, Tauroursodeoxycholic acid, sodium salt (6CI,7CI),2-[[(3α,5β,7β)-3,7-Dihydroxy-24-oxocholan-24-yl]amino]ethanesulfonic acid sodium salt (1:1), Ethanesulfonic acid, 2-[[(3α,5β,7β)-3,7-dihydroxy-24-oxocholan-24-yl]amino]-, monosodium salt (9CI)
IUPAC Namesodium;2-[[(4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate
Molecular Weight521.69
Molecular FormulaC26H44NO6S.Na
Canonical SMILES[Na+].C[C@H](CCC(=O)NCCS(=O)(=O)[O-])[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
InChIInChI=1S/C26H45NO6S.Na/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29;/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17+,18-,19-,20+,21+,22+,24+,25+,26-;/m1./s1
Accurate Mass521.2787
FormatNeat
SubcategoryChiral molecules, Enzyme inhibitors
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CATSizeShippingStorage Conditions
APS35807853-10MG 10MG Room Temperature -20°C Freezer Inquiry
APS35807853-5MG 5MG Room Temperature -20°C Freezer Inquiry
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