N-Acetylneuraminic Acid Methyl Ester

Analyte Name

N-Acetylneuraminic Acid Methyl Ester

CAS Number

22900-11-4

Molecular Formula

C12 H21 N O9

Molecular Weight

323.30

Accurate Mass

323.1216

SMILES

COC(=O)[C@]1(O)C[C@H](O)[C@@H](NC(=O)C)[C@@H](O1)[C@H](O)[C@H](O)CO

InChI

InChI=1S/C12H21NO9/c1-5(15)13-8-6(16)3-12(20,11(19)21-2)22-10(8)9(18)7(17)4-14/h6-10,14,16-18,20H,3-4H2,1-2H3,(H,13,15)/t6-,7+,8+,9+,10+,12-/m0/s1

IUPAC

methyl (2S,4S,5R,6R)-5-acetamido-2,4-dihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate

Alternate CAS Number

32766-94-2

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat