CAS 35807-85-3 appears in our catalog under these names: Tauroursodeoxycholic Acid Sodium Salt, Tauroursodeoxycholic Acid Sodium Salt (90%), >95% (HPLC), Tauroursodeoxycholate sodium/ 99.78% (existing batch purity), Sodium Tauroursodeoxycholate (TUDC), Tauroursodeoxycholic acid, sodium salt. Offered by: Chemat Brand, TRC, TargetMol, GLPBio, Biosynth. Available pack sizes: on request, 100mg, 1g, 500mg, 250mg, 5mg, 25mg, 50mg.
Sodium 2-[[(4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-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 (CAS 35807-85-3) is a chemical compound with the molecular formula C26H44NNaO6S and a molecular weight of 521.7 g/mol. IUPAC name: sodium 2-[[(4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-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. InChIKey: IYPNVUSIMGAJFC-JUWYWQLMSA-M.
| Molecular formula | C26H44NNaO6S |
|---|---|
| Molecular weight | 521.7 g/mol |
| IUPAC name | sodium 2-[[(4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-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 |
| InChIKey | IYPNVUSIMGAJFC-JUWYWQLMSA-M |
| SMILES | C[C@H](CCC(=O)NCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.[Na+] |
Computed by PubChem (NCBI)