2,4,7,8,9-Penta-O-acetyl-N-acetylneuraminic Acid Methyl Ester

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

Also Known As: 3134AH|2,4,7,8,9-Penta-O-acetyl-N-acetylneuraminic Acid Methyl Ester|N-Acetylneuraminic Acid Methyl Ester 2,4,7,8,9-Pentaacetate|N-acetylneuraminicAcidMethylEster2,4,7,8,9-Pentaacetate|2,4,7,8,9-Penta-O-acetyl-a-D-neuraminic acid methyl ester|(1S,2R)-1-((2R,3R,4S,6R)-3-acetamido-4,6-diacetoxy-6-(methoxycarbonyl)tetrahydro-2H-pyran-2-yl)propane-1,2,3-triyl triacetate|2,4,7,8,9-Penta-O-acetyl-N-acetylneuraminic acid methyl ester, 97%|2-O,4-O,N,7-O,8-O,9-O-Hexaacetyl-beta-neuraminic acid methyl ester|Methyl 5-acetamido-2,4,7,8,9-penta-O-acetyl-3,5-dideoxy-D-glycero-beta-D-galacto-2-nonulopyranosate|N,2-O,4-O,7-O,8-O,9-O-Hexaacetyl-beta-neuraminic acid methyl ester|N,4-O,7-O,8-O,9-O-Pentaacetyl-2-acetoxy-2-deoxy-beta-neuraminic acid methyl ester|N-Acetyl-2-O,4-O,7-O,8-O,9-O-pentaacetyl-beta-neuraminic acid methyl ester|(1S,2R)-1-((2R,3S,4S,6R)-3-acetamido-4,6-diacetoxy-6-(methoxycarbonyl)tetrahydro-2H-pyran-2-yl)propane-1,2,3-triyl triacetate|5-(Acetylamino)-2-O,4-O,7-O,8-O,9-O-pentaacetyl-3,5-dideoxy-beta-D-glycero-D-galacto-2-nonulopyranosonic acid methyl ester|METHYL (2R,4S,5R,6R)-2,4-BIS(ACETYLOXY)-5-ACETAMIDO-6-[(1S,2R)-1,2,3-TRIS(ACETYLOXY)PROPYL]OXANE-2-CARBOXYLATE|methyl (2R,4S,5R,6R)-5-acetamido-2,4-diacetyloxy-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate

Molecular Formula	C22H31NO14
Molecular Weight	533.17444 g/mol
LogP	-0.9294
Topological Polar Surface Area	196.13 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	14
Rotatable Bonds	10
Exact Mass	533.17444
Monoisotopic Mass	533.17444
Heavy Atoms	37
Complexity	917.0537

Chemical Identifiers

CAS Number	74006-95-4
SMILES	CC(=O)N[C@@H]1[C@H](C[C@](O[C@H]1[C@@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)(C(=O)OC)OC(=O)C)OC(=O)C