| název vyrobku |
simarolid |
| Synonyma |
Simarololid; kyselina 24-Nor-16,17-sekocholan-16,23-diová, 11-(acetyloxy)-2,7,21-trihydroxy-4,8-dimethyl-1,17-dioxo-, gama-lakton delta-lakton, (2alfa,4alfa,5alfa,7alfa,11alpha,13alfa,14beta,20R)-; (2alfa,11alfa)-2-hydroxy-1,16-dioxo-13-{[(3R)-5-oxotetrahydrofuran-3-yl]karbonyl}picrasan-11-yl-acetát |
| Anglicky název |
simarolide;Simarolide; 24-Nor-16,17-secocholane-16,23-dioic acid, 11-(acetyloxy)-2,7,21-trihydroxy-4,8-dimethyl-1,17-dioxo-, gamma-lactone delta-lactone, (2alpha,4alpha,5alpha,7alpha,11alpha,13alpha,14beta,20R)-; (2alpha,11alpha)-2-hydroxy-1,16-dioxo-13-{[(3R)-5-oxotetrahydrofuran-3-yl]carbonyl}picrasan-11-yl acetate |
| Molekulární vzorec |
C27H36O9 |
| Molekulová hmotnost |
504.5693 |
| InChI |
InChI=1/C27H36O9/c1-12-6-16(29)24(33)26(4)15(12)8-19-27(5)18(9-21(31)36-19)25(3,10-17(22(26)27)35-13(2)28)23(32)14-7-20(30)34-11-14/h12,14-19,22,29H,6-11H2,1-5H3/t12-,14-,15+,16+,17-,18+,19-,22-,25-,26+,27-/m1/s1 |
| Registra?ní ?íslo CAS |
1260-58-8 |
| Molekulární struktura |
|
| Hustota |
1.31g/cm3 |
| Bod varu |
696°C at 760 mmHg |
| Index lomu |
1.562 |
| Bod vzplanutí |
230.5°C |
| Tlak par |
2.09E-22mmHg at 25°C |
|
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