CAS 28192-77-0 to numer rejestracyjny substancji Methyl 3-p-Toluenesulfonate-cholic Acid Ester. Oferty producentów: TRC. Dostępne opakowania: 5g.
Methyl (4R)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-(4-methylphenyl)sulfonyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate (CAS 28192-77-0) to związek chemiczny o wzorze sumarycznym C32H48O7S i masie molowej 576.8 g/mol. Nazwa systematyczna IUPAC: methyl (4R)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-(4-methylphenyl)sulfonyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate. InChIKey: JSFIZXNNGPOFTB-PDVGBUMXSA-N.
| Wzór sumaryczny | C32H48O7S |
|---|---|
| Masa molowa | 576.8 g/mol |
| Nazwa IUPAC | methyl (4R)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-(4-methylphenyl)sulfonyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate |
| InChIKey | JSFIZXNNGPOFTB-PDVGBUMXSA-N |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]2CC[C@]3([C@@H](C2)C[C@H]([C@@H]4[C@@H]3C[C@@H]([C@]5([C@H]4CC[C@@H]5[C@H](C)CCC(=O)OC)C)O)O)C |
Dane obliczone przez PubChem (NCBI)