Hyaluronate Hexasaccharide

(2S,3S,4S,5R,6R)-6-[(2S,3R,4R,5S,6R)-3-acetamido-2-[(2S,3S,4R,5R,6R)-6-[(2S,3R,4R,5S,6R)-3-acetamido-2-[(2S,3S,4R,5R,6R)-6-[(2R,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-2-carboxy-4,5-dihydroxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-2-carboxy-4,5-dihydroxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

Also Known As: Hyaluronate Hexasaccharide|GlyTouCan:G01866TT|Epitope ID:231709|G01866TT|beta-D-GlcpA-(1->3)-beta-D-GlcpNAc-(1->4)-beta-D-GlcpA-(1->3)-beta-D-GlcpNAc-(1->4)-beta-D-GlcpA-(1->3)-beta-D-GlcpNAc|(beta-D-glucopyranosyluronic acid)-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-(beta-D-glucopyranosyluronic acid)-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-(beta-D-glucopyranosyluronic acid)-(1->3)-2-acetamido-2-deoxy-beta--glucopyranose|beta-D-GlcA-(1->3)-beta-D-GlcNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-GlcNAc-(1->4)-beta-D-GlcA-(1->3)-beta-D-GlcNAc|beta-D-glucopyranuronosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranuronosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranuronosyl-(1->3)-2-acetamido-2-deoxy-beta--glucopyranose|beta-D-glucuronosyl-(1->3)-N-acetyl-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-N-acetyl-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-N-acetyl-D-glucosamine

Molecular Formula	C42H65N3O34
Molecular Weight	1155.345 g/mol
LogP	-13.3921
Topological Polar Surface Area	583.95 Ų
Hydrogen Bond Donors	20
Hydrogen Bond Acceptors	31
Rotatable Bonds	19
Exact Mass	1155.345
Monoisotopic Mass	1155.345
Heavy Atoms	79
Complexity	2117.5159

Chemical Identifiers

CAS Number	73603-40-4
SMILES	CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)NC(=O)C)O)O)NC(=O)C)O)O