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Sel de sodium hydraté d'acide taurocholique, TRC
Specifications
Specifications
| Nom chimique ou matériau | Taurocholic Acid Sodium Salt Hydrate |
| CAS | 345909-26-4 |
| Notes de qualité de la pureté | HPLC |
| Formule moléculaire | C26 H44 N O7 S . Na . 2 H2 O |
| Quantité | 250 mg |
| Formule InChI | InChI=1S/C26H45NO7S.Na.2H2O/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29;;;/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34);;2*1H2/q;+1;;/p-1/t15-,16?,17-,18-,19+,20+,21-,22+,24+,25+,26-;;;/m1.../s1 |
| SMILES | O.O.[Na+].C[C@H](CCC(=O)NCCS(=O)(=O)[O-])[C@H]1CC[C@H]2[C@@H]3[C@H](O)CC4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C |
| Nom IUPAC | sodium;2-[[(4R)-4-[(3R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-diméthyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tétradécahydro-1H-cyclopenta[a]phénanthrén-17-yl]pentanoyl]amino]éthanesulfonate;dihydrate |
| Poids moléculaire (g/mol) | 573.72 |
| Poids de la formule | 573.2947 |
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