tetra-N-acetylchitotetraose

N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R)-5-acetamido-3,4-bis[[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-1-hydroxy-6-oxohexan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

Also Known As: Tetra-N-acetylchitotetraose|N,N,N-Tetraacetylchitotetraose|CHITOTETRAOSE,TETRA-N-ACETYL|N,N,N,N-Tetraacetyl chitotetraose|N,N',N'',N'''-Tetraacetylchitintetraose|CHITOTETRAOSE, TETRA-N-ACETYL|N,N',N'',N'''-Tetraacetylchitotetraose|N,N',N'',N t' -Tetraacetylchitotetraose|GlcNAcbeta1-4GlcNAcbeta1-4GlcNAcbeta1-4GlcNAc|GlcNAc1-beta-4GlcNAc1-beta-4GlcNAc1-beta-4GlcNAc|B1370-177615|N,N',N'',N'''-Tetraacetyl chitotetraose, 95% - 10MG 10mg|N-[(2S,3R,4R,5S,6R)-2-[(2R,3S,4R,5R)-5-acetamido-3,4-bis[[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-1-hydroxy-6-oxohexan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide|D-Glucose, O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-4)-2-(acetylamino)-2-deoxy-

Molecular Formula	C32H54N4O21
Molecular Weight	830.32806 g/mol
LogP	-9.331
Topological Polar Surface Area	391.15 Ų
Hydrogen Bond Donors	14
Hydrogen Bond Acceptors	21
Rotatable Bonds	18
Exact Mass	830.32806
Monoisotopic Mass	830.32806
Heavy Atoms	57
Complexity	1350.7192

Chemical Identifiers

CAS Number	2706-65-2
SMILES	CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H](C=O)NC(=O)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)NC(=O)C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC(=O)C)CO)O)O