N-Acetyl-alpha-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminylproteoglycan

Properties Image MNX_ID MNXM12342 reference chebi:79980 formula C22H35N2O17* global charge 0 mol weight   InChIKey   InChI   SMILES [*]O[C@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1NC(C)=O MNX internals InChI (mnx) InChI=1/C23H38N2O17/c1-6(28)24-10-13(31)12(30)8(4-26)38-22(10)41-18-15(33)16(34)23(42-19(18)20(35)36)40-17-9(5-27)39-21(37-3)11(14(17)32)25-7(2)29/h8-19,21-23,26-27,30-34H,4-5H2,1-3H3,(H,24,28)(H,25,29)(H,35,36)/t8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18+,19+,21+,22-,23-/m1/s1/i3+1 SMILES (mnx) [CH3:1][C:6](=[N:24][C@@H:10]1[C@@H:13]([OH:31])[C@H:12]([OH:30])[C@@H:8]([CH2:4][OH:26])[O:38][C@@H:22]1[O:41][C@H:18]1[C@H:15]([OH:33])[C@@H:16]([OH:34])[C@H:23]([O:40][C@@H:17]2[C@@H:9]([CH2:5][OH:27])[O:39][C@H:21]([O:37][13CH3:3])[C@H:11]([N:25]=[C:7]([CH3:2])[OH:29])[C@H:14]2[OH:32])[O:42][C@@H:19]1[C:20](=[O:35])[OH:36])[OH:28]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0