Analytenname

(S)-Cotinine-d3 N-beta-D-Glucuronide

Molekularformel

C16 D3 H17 N2 O7

Molekulargewicht

355.358

Genaue Masse

355.146

SMILES

[2H]C([2H])([2H])N1[C@@H](CCC1=O)c2ccc[n+](c2)[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)[O-]

InChI

InChI=1S/C16H20N2O7/c1-17-9(4-5-10(17)19)8-3-2-6-18(7-8)15-13(22)11(20)12(21)14(25-15)16(23)24/h2-3,6-7,9,11-15,20-22H,4-5H2,1H3/t9-,11-,12-,13+,14-,15+/m0/s1/i1D3

IUPAC

(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[3-[(2S)-5-oxo-1-(trideuteriomethyl)pyrrolidin-2-yl]pyridin-1-ium-1-yl]oxane-2-carboxylate

SIL-Typ

Deuterium

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produkttyp

Stable Isotope Labelled

Produktformat

Neat