Products 207737-97-1

CAS 207737-97-1 appears in our catalog under these names: Taurodeoxycholic Acid (sodium salt hydrate), Taurodeoxycholic acid sodium salt hydrate, 97%, Taurodeoxycholic acid, sodium salt hydrate, 97%, Sodium taurodeoxycholate hydrate/ 95%, Sodium taurodeoxycholate hydrate. Offered by: GLPBio, Combi-blocks, Thermo Scientific (Acros), TargetMol, Biosynth. Available pack sizes: 1g, 5g, 25g, 500mg, 10g, 50g, 100g, 250g.

Structural formula: {0} (CAS {1})

Sodium taurodeoxycholate hydrate is a cholanoid. It is functionally related to a taurodeoxycholic acid.

Source: ChEBI

Identity
Molecular formulaC26H46NNaO7S
Molecular weight539.7 g/mol
IUPAC namesodium;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;hydrate
InChIKeyOLPIZAYYAVQETM-GGPRKOIFSA-M
SMILESC[C@H](CCC(=O)NCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.O.[Na+]

Computed by PubChem (NCBI)