Zolmitriptan Namino-sucraloside (Mixture)

Analyte Name

Zolmitriptan Namino-sucraloside (Mixture)

Molecular Formula

C28H40Cl3N3O10

Molecular Weight

684.99

Accurate Mass

683.18

SMILES

Cl[C@@H]1[C@H](O)[C@@H](O)[C@@H](O[C@@]2(CCl)[C@@H](O)[C@H](O)[C@@H](C[N+](C)(C)CCC3=CNC4=C3C=C(C[C@H](CO5)NC5=O)C=C4)O2)O[C@@H]1CO.Cl[C@@H]6[C@H](O)[C@@H](O)[C@@H](O[C@@]7(C[N+](C)(C)CCC8=CNC9=C8C=C(C[C@H](CO%10)NC%10=O)C=C9)[C@@H](O)[C@H](O)[C@@H](CCl)O7)O[C@@H]6CO.[Cl-].[Cl-]

InChI

InChI=1S/2C28H39Cl2N3O10.2ClH/c1-33(2,6-5-15-10-31-18-4-3-14(8-17(15)18)7-16-12-40-27(39)32-16)13-28(25(38)22(35)19(9-29)42-28)43-26-24(37)23(36)21(30)20(11-34)41-26;1-33(2,6-5-15-9-31-18-4-3-14(8-17(15)18)7-16-12-40-27(39)32-16)10-19-22(35)25(38)28(13-29,42-19)43-26-24(37)23(36)21(30)20(11-34)41-26;;/h3-4,8,10,16,19-26,31,34-38H,5-7,9,11-13H2,1-2H3;3-4,8-9,16,19-26,31,34-38H,5-7,10-13H2,1-2H3;2*1H/t2*16-,19-,20-,21+,22-,23+,24-,25+,26-,28+;;/m11../s1

IUPAC

N-(((2R,3S,4S,5R)-5-(((2R,3R,4R,5R,6R)-5-chloro-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-(chloromethyl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)-N,N-dimethyl-2-(5-(((R)-2-oxooxazolidin-4-yl)methyl)-1H-indol-3-yl)ethan-1-aminium N-(((2S,3S,4S,5S)-2-(((2R,3R,4R,5R,6R)-5-chloro-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-(chloromethyl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)-N,N-dimethyl-2-(5-(((R)-2-oxooxazolidin-4-yl)methyl)-1H-indol-3-yl)ethan-1-aminium chloride

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat