Globoside Gb3 (d18:1(4E)/22:4(7Z,10Z,13Z,16Z))

Properties Image Occurences in reactions MNX_ID MNXM522276 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C58H101NO18 charge 0 mass 1099.70187 reference slm:000485776 InChIKey IKRPEFXHJMULJX-KRRVLGQXSA-N InChI InChI=1S/C58H101NO18/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-46(64)59-41(42(63)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2)40-72-56-52(70)49(67)54(44(38-61)74-56)77-58-53(71)50(68)55(45(39-62)75-58)76-57-51(69)48(66)47(65)43(37-60)73-57/h11,13,17-18,20-21,24,26,33,35,41-45,47-58,60-63,65-71H,3-10,12,14-16,19,22-23,25,27-32,34,36-40H2,1-2H3,(H,59,64)/b13-11-,18-17-,21-20-,26-24-,35-33+/t41-,42+,43+,44+,45+,47-,48-,49+,50+,51+,52+,53+,54+,55-,56+,57+,58-/m0/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph