beta-D-Glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl-(1->4)-beta-D-glucuronosylproteoglycan

Properties Image MNX_ID MNXM10801 reference chebi:79982 formula C20H30NO18* global charge 0 mol weight   InChIKey   InChI   SMILES [*]O[C@@H]1O[C@H](C(=O)O)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C21H33NO18/c1-4(24)22-6-7(25)13(37-21-11(29)8(26)9(27)15(39-21)17(31)32)5(3-23)36-19(6)38-14-10(28)12(30)20(35-2)40-16(14)18(33)34/h5-16,19-21,23,25-30H,3H2,1-2H3,(H,22,24)(H,31,32)(H,33,34)/t5-,6-,7-,8+,9+,10-,11-,12-,13-,14+,15+,16+,19-,20-,21-/m1/s1/i2+1 SMILES (mnx) [CH3:1][C:4](=[N:22][C@@H:6]1[C@@H:7]([OH:25])[C@H:13]([O:37][C@H:21]2[C@H:11]([OH:29])[C@@H:8]([OH:26])[C@H:9]([OH:27])[C@@H:15]([C:17](=[O:31])[OH:32])[O:39]2)[C@@H:5]([CH2:3][OH:23])[O:36][C@@H:19]1[O:38][C@H:14]1[C@H:10]([OH:28])[C@@H:12]([OH:30])[C@H:20]([O:35][13CH3:2])[O:40][C@@H:16]1[C:18](=[O:33])[OH:34])[OH:24]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0