Products 2936622-38-5
CAS 2936622-38-5 appears in our catalog under these names: Tauro-3α,6α,7α,12α-tetrahydroxy bile acid (sodium), Tauro-3α,6α,7α,12α-tetrahydroxy bile. Offered by: MedChemExpress, Sigma-Aldrich. Available pack sizes: Get quote, 1MG.
Sodium 2-[[(4R)-4-[(3R,5R,6R,7S,8R,9S,10R,12S,13R,14S,17R)-3,6,7,12-tetrahydroxy-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 2936622-38-5) is a chemical compound with the molecular formula C26H44NNaO8S and a molecular weight of 553.7 g/mol. IUPAC name: sodium 2-[[(4R)-4-[(3R,5R,6R,7S,8R,9S,10R,12S,13R,14S,17R)-3,6,7,12-tetrahydroxy-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: HABFLDPOUGIPIG-HUDNFYPQSA-M.
| Molecular formula | C26H44NNaO8S |
|---|---|
| Molecular weight | 553.7 g/mol |
| IUPAC name | sodium 2-[[(4R)-4-[(3R,5R,6R,7S,8R,9S,10R,12S,13R,14S,17R)-3,6,7,12-tetrahydroxy-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 | HABFLDPOUGIPIG-HUDNFYPQSA-M |
| SMILES | C[C@H](CCC(=O)NCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H]([C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)O)C.[Na+] |
Computed by PubChem (NCBI)
Synonyms:
orb3145141