Analyte Name

Lincomycin-13C,D3 Sulfoxide

Molecular Formula

C17¹³CH31D3N2O7S

Molecular Weight

426.55

Accurate Mass

426.33

SMILES

O[C@@H]1[C@@H]([C@H]([C@H](O[C@@H]1[C@@H]([C@@H](C)O)NC([C@H]2N([13C]([2H])([2H])[2H])C[C@@H](C2)CCC)=O)S(C)=O)O)O

InChI

InChI=1S/C18H34N2O7S/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(27-16)28(4)26/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25)/t9-,10-,11+,12-,13+,14-,15-,16-,18-,28?/m1/s1/i3+1D3

IUPAC

(2S,4R)-N-((1R,2R)-2-hydroxy-1-((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylsulfinyl)tetrahydro-2H-pyran-2-yl)propyl)-1-(methyl-13C-d3)-4-propylpyrrolidine-2-carboxamide

Unlabelled CAS Number

22083-92-7

SIL Type

Deuterium, Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat