CAS: 207737-97-1 Molecular Formula: C26H44NNaO6S Molecular Weight (g/mol): 521.69 MDL Number: MFCD00149238 InChI Key: YXHRQQJFKOHLAP-FVCKGWAHSA-M Synonym: Sodium taurodeoxylate PubChem CID: 23702150 IUPAC Name: 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;hydrate SMILES: [Na+].[H][C@@]12CC[C@H]([C@H](C)CCC(=O)NCCS([O-])(=O)=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@H](O)CC[C@]12C