N-Acetyl-3-fluoroneuraminic acid
[CAS# 129950-58-9]

Identification

• Name: N-Acetyl-3-fluoroneuraminic acid
• Synonyms: N-Acetyl-3-Fluoroneuraminic Acid; (3Xi)-5-(Acetylamino)-3,5-Dideoxy-3-(Fluoro-18F)-D-Glycero-D-Galacto-2-Nonulosonic Acid; 3-(18F)Neu5ac
• Molecular Formula: C₁₁H₁₈FNO₉
• Molecular Weight: 327.26
• CAS Registry Number: 129950-58-9
• SMILES: [18F]C(C(C(O)=O)=O)C(C(C(C(C(CO)O)O)O)NC(C)=O)O
• InChI: 1S/C11H18FNO9/c1-3(15)13-6(10(20)7(17)4(16)2-14)8(18)5(12)9(19)11(21)22/h4-8,10,14,16-18,20H,2H2,1H3,(H,13,15)(H,21,22)/i12-1
• InChIKey: NPUIAVLGTMSGBB-DWSYCVKZSA-N

Properties

• Density: 1.612g/cm³ (Cal.)