Analyte Name

5-(Methoxycarbonylmethyl)-2-thiouridine

CAS Number

20299-15-4

Molecular Formula

C12 H16 N2 O7 S

Molecular Weight

332.33

Accurate Mass

332.068

SMILES

COC(=O)CC1=CN([C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)C(=S)NC1=O

InChI

InChI=1S/C12H16N2O7S/c1-20-7(16)2-5-3-14(12(22)13-10(5)19)11-9(18)8(17)6(4-15)21-11/h3,6,8-9,11,15,17-18H,2,4H2,1H3,(H,13,19,22)/t6-,8+,9+,11-/m1/s1

IUPAC

methyl 2-[1-[(2R,3S,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-2-sulfanylidenepyrimidin-5-yl]acetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat