CAS 75672-42-3 to numer rejestracyjny substancji Glycocholic Acid 3-O-beta-Glucuronide Disodium Salt. Oferty producentów: Chemat Brand, TRC. Dostępne opakowania: on request, 50mg.
Disodium;(2S,3S,5R,6R)-6-[[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5-(2-carboxylatoethylamino)-5-oxopentan-2-yl]-7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylate (CAS 75672-42-3) to związek chemiczny o wzorze sumarycznym C33H51NNa2O12 i masie molowej 699.7 g/mol. Nazwa systematyczna IUPAC: disodium;(2S,3S,5R,6R)-6-[[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5-(2-carboxylatoethylamino)-5-oxopentan-2-yl]-7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylate. InChIKey: LTRHJPNIEWJQKP-FXWCFQNQSA-L.
| Wzór sumaryczny | C33H51NNa2O12 |
|---|---|
| Masa molowa | 699.7 g/mol |
| Nazwa IUPAC | disodium;(2S,3S,5R,6R)-6-[[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5-(2-carboxylatoethylamino)-5-oxopentan-2-yl]-7,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylate |
| InChIKey | LTRHJPNIEWJQKP-FXWCFQNQSA-L |
| SMILES | C[C@H](CCC(=O)NCCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O[C@H]5[C@@H](C([C@@H]([C@H](O5)C(=O)[O-])O)O)O)C)O)O)C.[Na+].[Na+] |
Dane obliczone przez PubChem (NCBI)