beta-D-Galp6S-(1->4)-beta-D-GlcpNAc6S

Properties Image MNX_ID MNXM103128 reference chebi:65183 formula C14H25NO17S2 global charge 0 mol weight 543.478 InChIKey UJOAXSJVYJPWAV-LODBTCKLSA-N InChI InChI=1S/C14H25NO17S2/c1-4(16)15-7-9(18)12(6(30-13(7)21)3-29-34(25,26)27)32-14-11(20)10(19)8(17)5(31-14)2-28-33(22,23)24/h5-14,17-21H,2-3H2,1H3,(H,15,16)(H,22,23,24)(H,25,26,27)/t5-,6-,7-,8+,9-,10+,11-,12-,13-,14+/m1/s1 SMILES CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](COS(=O)(=O)O)[C@H](O)[C@H](O)[C@H]2O)[C@@H](COS(=O)(=O)O)O[C@H]1O MNX internals InChI (mnx) InChI=1/C14H25NO17S2/c1-4(16)15-7-9(18)12(6(30-13(7)21)3-29-34(25,26)27)32-14-11(20)10(19)8(17)5(31-14)2-28-33(22,23)24/h5-14,17-21H,2-3H2,1H3,(H,15,16)(H,22,23,24)(H,25,26,27)/t5-,6-,7-,8+,9-,10+,11-,12-,13-,14+/m1/s1 SMILES (mnx) [CH3:1][C:4](=[N:15][C@@H:7]1[C@@H:9]([OH:18])[C@H:12]([O:32][C@H:14]2[C@H:11]([OH:20])[C@@H:10]([OH:19])[C@@H:8]([OH:17])[C@@H:5]([CH2:2][O:28][S:33]([OH:22])(=[O:23])=[O:24])[O:31]2)[C@@H:6]([CH2:3][O:29][S:34]([OH:25])(=[O:26])=[O:27])[O:30][C@H:13]1[OH:21])[OH:16]

Parent-child relations graph

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