beta-D-GlcpA-(1->3)-beta-D-GalpNAc6S

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

Also Known As: chondroitin sulfate C|Chondroitin 6-sulfate|chondroitin 6'-sulfate|GlyTouCan:G18253ON|GlcA(b1-3)b-GalNAc6S|NG6-(3-1)GCU|chondroitin 6-(hydrogen sulfate)|G18253ON|beta-D-GlcpA-(1->3)-beta-D-GalpNAc6S|J2.192.301J|(2S,3S,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-3-acetamido-2,5-dihydroxy-6-(sulfooxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid|2-acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-6-O-sulfo-beta-D-galactopyranose|6-O-Sulfo-3-O-(6-oxo-beta-D-glucopyranosyl)-2-(acetylamino)-2-deoxy-beta-D-galactopyranose|(2S,3S,4S,5R,6R)-6-{[(2R,3R,4R,5R,6R)-3-acetamido-2,5-dihydroxy-6-[(sulfooxy)methyl]oxan-4-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid|WURCS=2.0/2,2,1/[a2112h-1b_1-5_2*NCC/3=O_6*OSO/3=O/3=O][a2122A-1b_1-5]/1-2/a3-b1

Molecular Formula	C14H23NO15S
Molecular Weight	477.07883 g/mol
LogP	-5.334
Topological Polar Surface Area	258.84 Ų
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	13
Rotatable Bonds	7
Exact Mass	477.07883
Monoisotopic Mass	477.07883
Heavy Atoms	31
Complexity	760.81104

Chemical Identifiers

CAS Number	25322-46-7
SMILES	CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1O)COS(=O)(=O)O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O