chondroitin sulfate disaccharide

Properties Image Occurences in reactions MNX_ID MNXM16695 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C14H21NO18S2 charge -2 mass 555.0211 reference metacycM:Chondroitin-sulfate-disaccharides InChIKey KYXFEXHDCVKJRO-WUDOWALASA-L InChI InChI=1S/C14H23NO18S2/c1-3(17)15-5-9(8(32-34(23,24)25)4(2-16)29-13(5)22)30-14-11(33-35(26,27)28)7(19)6(18)10(31-14)12(20)21/h4-11,13-14,16,18-19,22H,2H2,1H3,(H,15,17)(H,20,21)(H,23,24,25)(H,26,27,28)/p-2/t4-,5-,6+,7+,8+,9-,10+,11-,13-,14-/m1/s1 SMILES CC(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@H](OS(=O)(=O)[O-])[C@@H]1O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1OS(=O)(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph