Analyte Name

Nicotinamide Riboside-2-13C,15N Triflate (alpha/beta mixture)

Molecular Formula

C11 13C H15 F3 N 15N O8 S

Molecular Weight

406.3

Accurate Mass

406.05

SMILES

FC(S(=O)([O-])=O)(F)F.O[13C@@H]1[C@@H]([C@H](OC1[N+]2=CC(C([15NH2])=O)=CC=C2)CO)O

InChI

InChI=1S/C11H14N2O5.CHF3O3S/c12-10(17)6-2-1-3-13(4-6)11-9(16)8(15)7(5-14)18-11;2-1(3,4)8(5,6)7/h1-4,7-9,11,14-16H,5H2,(H-,12,17);(H,5,6,7)/t7-,8-,9-,11?;/m1./s1/i9+1,12+1;

IUPAC

3-(Carbamoyl-15N)-1-((3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl-3-13C)pyridin-1-ium trifluoromethanesulfonate

SIL Type

Nitrogen, Carbon

Country of Origin

CANADA

Product Format

Neat