Sodium taurocholate
| Catalog Number | BL-M000518 |
| CAS Number | 145-42-6 |
| Description | Sodium taurocholate is a natural compound from Animal biles. |
 | |
| IUPAC Name | sodium;2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 |
| Synonyms | 5beta-cholanic acid-3alpha,7alpha,12alpha-triol N-(2-sulphoethyl)-amide, sodium salt; Monosodium taurocholate; Taurocholate sodium salt |
| Molecular Weight | 537.7 |
| Molecular Formula | C26H44NNaO7S |
| Melting Point | 230 °C |
| Purity | 98% |
| Density | 1.177 g/cm3 at 22.5 °C |
| Solubility | Soluble in Water |
| Appearance | Brown to Greenish Brown Solid |
| Application | Cholagogues and Choleretics |
| Shelf Life | 1 Year |
| Storage | Store at -20°C |
| Percent Composition | C 58.08%, H 8.25%, N 2.61%, Na 4.28%, O 20.83%, S 5.96% |
| Canonical SMILES | CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C.[Na+] |
| InChI | InChI=1S/C26H45NO7S.Na/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);/q;+1/p-1/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-;/m1./s1 |
| InChI Key | JAJWGJBVLPIOOH-IZYKLYLVSA-M |
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