Analytenname

Prednisone Glucuronide

Molekularformel

C28 H36 O11

Molekulargewicht

548.579

Genaue Masse

548.226

SMILES

COC(=O)[C@H]1O[C@@H](OCC(=O)[C@@]2(O)CCC3C4CCC5=CC(=O)C=C[C@]5(C)C4C(=O)C[C@]23C)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChI=1S/C28H36O11/c1-26-8-6-14(29)10-13(26)4-5-15-16-7-9-28(36,27(16,2)11-17(30)19(15)26)18(31)12-38-25-22(34)20(32)21(33)23(39-25)24(35)37-3/h6,8,10,15-16,19-23,25,32-34,36H,4-5,7,9,11-12H2,1-3H3/t15?,16?,19?,20-,21-,22+,23-,25+,26-,27-,28-/m0/s1

IUPAC

methyl (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[2-[(10R,13S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]oxane-2-carboxylate

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produktformat

Neat