Taurodeoxycholic Acid-D4 Sodium Salt

Product Name Taurodeoxycholic Acid-D4 Sodium Salt
CAT No. CS-I-00389
CAS No. 1180-95-6(Unlabeled)
Category Stable Isotopes
Stock IN-Stock
Mol. Wt. 525.71 g/mol
Mol. For. C₂₆D₄H₄₀NNaO₆S
Hazardous This is a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Canonical Smiles CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C.[Na+]
InchIKey YXHRQQJFKOHLAP-FVCKGWAHSA-M
Inchl InChI=1S/C26H45NO6S.Na/c1-16(4-9-24(30)27-12-13-34(31,32)33)20-7-8-21-19-6-5-17-14-18(28)10-11-25(17,2)22(19)15-23(29)26(20,21)3;/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-;/m1./s1
IUPAC sodium;2-[[(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-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
Controlled No
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Taurodeoxycholic Acid-D4 Sodium Salt is a derivative of taurodeoxycholic acid, which belongs to the family of bile acids. It is commonly used as a reference standard in mass spectrometry-based quantification of bile acids in biological samples. The stable isotope-labeled version of taurodeoxycholic acid-D4 sodium salt is used as an internal standard in mass spectrometry-based quantification of bile acids in biological samples. Taurodeoxycholic acid-D4 sodium salt has a molecular weight of 536.7 g/mol and a chemical formula of C26H40D4NNaO6S. The sodium salt form of taurodeoxycholic acid-D4 is more soluble in water than its free acid form, making it easier to use in certain applications. In addition to its use as a reference standard, taurodeoxycholic acid-D4 sodium salt has potential therapeutic applications in the treatment of liver diseases. Bile acids play a critical role in the regulation of cholesterol metabolism and lipid absorption in the liver, and taurodeoxycholic acid-D4 sodium salt could potentially be used to modulate these pathways to treat liver diseases such as nonalcoholic fatty liver disease and primary biliary cholangitis. Overall, taurodeoxycholic acid-D4 sodium salt is a useful tool in mass spectrometry-based quantification of bile acids, and has potential therapeutic applications in the treatment of liver diseases.

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