Analyte Name

Trilithium UDP-glucuronic Acid-13C1, 15N2

Molecular Formula

C14¹³CH22¹⁵N2O18P2 • 3(Li)

Molecular Weight

604.08

Accurate Mass

604.09

SMILES

O[C@@H]1[C@@H]([C@H](O[C@H]1[15N]([13C]([15NH]2)=O)C=CC2=O)COP(O)(OP(O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(O)=O)O)O)O)(O)=O)=O)O.[Li].[Li].[Li]

InChI

InChI=1S/C15H22N2O18P2.3Li/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25;;;/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26);;;/t4-,6-,7+,8+,9-,10-,11+,12-,14-;;;/m1.../s1/i15+1,16+1,17+1;;;

IUPAC

(2S,3S,4S,5R,6R)-6-(((((((2R,3S,4R,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl-2-13C-1,3-15N2)-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid, trilithium salt

Unlabelled CAS Number

109667-39-2

SIL Type

Carbon, Nitrogen

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat