N-Succinyl-5-aminoimidazole-4-carboxamide Ribose Disodium Salt

Analyte Name

N-[(5-Amino-1-Beta-D-ribofuranosyl-1H-imidazol-4-yl)carbonyl]-L-aspartic Acid Disodium Salt

Molecular Formula

C13H16N4Na2O9

Molecular Weight

418.27

Accurate Mass

418.07

SMILES

NC(N([C@H]1[C@H](O)[C@H](O)[C@@H](CO)O1)C=N2)=C2C(N[C@H](C(O[Na])=O)CC(O[Na])=O)=O

InChI

InChI=1S/C13H18N4O9.2Na/c14-10-7(11(23)16-4(13(24)25)1-6(19)20)15-3-17(10)12-9(22)8(21)5(2-18)26-12;;/h3-5,8-9,12,18,21-22H,1-2,14H2,(H,16,23)(H,19,20)(H,24,25);;/q;2*+1/p-2/t4?,5-,8?,9?,12-;;/m0../s1

IUPAC

sodium (5-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1H-imidazole-4-carbonyl)-L-aspartate

Alternate CAS Number

17388-80-6 free acid

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

Purity

>95% (HPLC)