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Taurodeoxycholic Acid Sodium Salt-[d4] Hydrate

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General Information
Catalog: BLP-004540
Molecular Formula: C26H44D4NNaO7S
Molecular Weight: 545.7

Chemical Structure

Description	Isotopic labelled Sodium taurodeoxycholate hydrate is a bile salt-related, anionic detergent used for isolation of membrane proteins.
IUPAC Name	sodium;hydride;2-[[(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-2,2,4,4-tetradeuterio-3,12-dihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid;hydrate
Related CAS	207737-97-1 (unlabelled)
Canonical SMILES	[H-].CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C.O.[Na+]
InChI	InChI=1S/C26H45NO6S.Na.H2O.H/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);;1H2;/q;+1;;-1/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-;;;/m1.../s1/i10D2,14D2;;;
InChI Key	FFBBCHDWOAQCMV-KMFNNRNVSA-N
Purity	>98%