Nombre del analito

Prenalterol Methyl Ether-d7

Fórmula molecular

C25 H38 O8

Peso molecular

466.564

Masa exacta

466.257

SMILES

C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@H]2CC[C@@]4(C)[C@@H]3CCC4=O)O[C@@H]5OC([C@H](O)C(O)C5O)C(=O)O

InChI

InChI=1S/C25H38O8/c1-24-9-7-13(32-23-20(29)18(27)19(28)21(33-23)22(30)31)11-12(24)3-4-14-15-5-6-17(26)25(15,2)10-8-16(14)24/h12-16,18-21,23,27-29H,3-11H2,1-2H3,(H,30,31)/t12-,13+,14+,15-,16-,18?,19-,20?,21?,23-,24+,25+/m1/s1

IUPAC

(3R,6R)-6-[[(3S,5R,8R,9R,10S,13S,14R)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Número CAS sin etiquetar

96996-91-7

Tipo SIL

Deuterium

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat