Produkty 81988-76-3
CAS 81988-76-3 to numer rejestracyjny substancji Paulomycin B. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.
(3S)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-[(1S)-1-(2-methylpropanoyloxy)ethyl]oxan-2-yl]oxy-5-[(Z)-2-isothiocyanatobut-2-enoyl]oxyoxan-2-yl]-2,3-dihydroxy-6-imino-5-oxocyclohexene-1-carboxylic acid (CAS 81988-76-3) to związek chemiczny o wzorze sumarycznym C33H44N2O17S i masie molowej 772.8 g/mol. Nazwa systematyczna IUPAC: (3S)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-[(1S)-1-(2-methylpropanoyloxy)ethyl]oxan-2-yl]oxy-5-[(Z)-2-isothiocyanatobut-2-enoyl]oxyoxan-2-yl]-2,3-dihydroxy-6-imino-5-oxocyclohexene-1-carboxylic acid. InChIKey: MXSSKXQZXUFIJA-HDAXSHDCSA-N.
| Wzór sumaryczny | C33H44N2O17S |
|---|---|
| Masa molowa | 772.8 g/mol |
| Nazwa IUPAC | (3S)-3-[(2R,3R,4S,5R,6R)-6-(acetyloxymethyl)-3-hydroxy-4-[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyl-5-[(1S)-1-(2-methylpropanoyloxy)ethyl]oxan-2-yl]oxy-5-[(Z)-2-isothiocyanatobut-2-enoyl]oxyoxan-2-yl]-2,3-dihydroxy-6-imino-5-oxocyclohexene-1-carboxylic acid |
| InChIKey | MXSSKXQZXUFIJA-HDAXSHDCSA-N |
| SMILES | C/C=C(/C(=O)O[C@@H]1[C@H](O[C@H]([C@@H]([C@@H]1O[C@H]2C[C@@H]([C@]([C@@H](O2)C)([C@H](C)OC(=O)C(C)C)O)OC)O)[C@]3(CC(=O)C(=N)C(=C3O)C(=O)O)O)COC(=O)C)\N=C=S |
Dane obliczone przez PubChem (NCBI)
Synonimy:
Paulomycin B, VOLONOMYCIN B