N-Acetyl-4-O-acetylneuraminate

Molecular Formula: C₁₃H₂₁NO₁₀

InChI: InChI=1/C13H21NO10/c1-5(16)14-9-8(23-6(2)17)3-13(22,12(20)21)24-11(9)10(19)7(18)4-15/h7-11,15,18-19,22H,3-4H2,1-2H3,(H,14,16)(H,20,21)/t7?,8-,9+,10?,11+,13-/m0/s1/f/h14,20H

InChIKey: InChIKey=LVBIMVQYUKOENY-WCDZKDPVDO
SMILES: CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)O)OC(=O)C

Names:
    C04015
    N-Acetyl-4-O-acetylneuraminate
    (2S,4S,5S,6R)-5-acetamido-4-acetyloxy-2-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid

Registries:
    PubChem CID 440197
    PubChem ID 6721