Products 98712-63-1

CAS 98712-63-1 is the registry number for 4,7,8,9-Tetra-O-acetyl-N-acetyl-2-deoxy-2-fluoro-b-D-neuraminic acid allyl ester. Offered by: Biosynth. Available pack sizes: 1g.

Structural formula: {0} (CAS {1})

Prop-2-enyl (2R,5R)-5-acetamido-4-acetyloxy-2-fluoro-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate (CAS 98712-63-1) is a chemical compound with the molecular formula C22H30FNO12 and a molecular weight of 519.5 g/mol. IUPAC name: prop-2-enyl (2R,5R)-5-acetamido-4-acetyloxy-2-fluoro-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate. InChIKey: KWVQXZVFGDOBNV-XKLSDLROSA-N.

Identity
Molecular formulaC22H30FNO12
Molecular weight519.5 g/mol
IUPAC nameprop-2-enyl (2R,5R)-5-acetamido-4-acetyloxy-2-fluoro-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate
InChIKeyKWVQXZVFGDOBNV-XKLSDLROSA-N
SMILESCC(=O)N[C@@H]1C(C[C@](OC1[C@@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)(C(=O)OCC=C)F)OC(=O)C

Computed by PubChem (NCBI)