3-O-(6-O-alpha-D-xylosylphospho-alpha-D-mannopyranosyl)-alpha-D-mannopyranose

Properties Image MNX_ID MNXM4991 reference chebi:61665 formula C17H30O18P global charge -1 mol weight 553.383 InChIKey VKSIIEJIUCAGDU-INGYFCGZSA-M InChI InChI=1S/C17H31O18P/c18-1-5-9(22)14(13(26)15(27)32-5)34-17-12(25)10(23)8(21)6(33-17)3-31-36(28,29)35-16-11(24)7(20)4(19)2-30-16/h4-27H,1-3H2,(H,28,29)/p-1/t4-,5-,6-,7+,8-,9-,10+,11-,12+,13+,14+,15+,16-,17-/m1/s1 SMILES O=P([O-])(OC[C@H]1O[C@H](O[C@@H]2[C@H](O)[C@@H](O)O[C@H](CO)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O)O[C@H]1OC[C@@H](O)[C@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C17H31O18P/c18-1-5-9(22)14(13(26)15(27)32-5)34-17-12(25)10(23)8(21)6(33-17)3-31-36(28,29)35-16-11(24)7(20)4(19)2-30-16/h4-27H,1-3H2,(H,28,29)/t4-,5-,6-,7+,8-,9-,10+,11-,12+,13+,14+,15+,16-,17-/m1/s1 SMILES (mnx) [CH2:1]([C@@H:5]1[C@@H:9]([OH:22])[C@H:14]([O:34][C@@H:17]2[C@@H:12]([OH:25])[C@@H:10]([OH:23])[C@H:8]([OH:21])[C@@H:6]([CH2:3][O:31][P:36]([OH:28])(=[O:29])[O:35][C@@H:16]3[C@H:11]([OH:24])[C@@H:7]([OH:20])[C@H:4]([OH:19])[CH2:2][O:30]3)[O:33]2)[C@H:13]([OH:26])[C@@H:15]([OH:27])[O:32]1)[OH:18]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 1