Ganglioside GD3 (d18:1(4E)/32:4(17Z,20Z,23Z,26Z))

Properties Image Occurences in reactions MNX_ID MNXM523180 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C84H143N3O29 charge -2 mass 1657.98182 reference slm:000487029 InChIKey KNDOHKZZBDHDRV-WMHCAEBFSA-L InChI InChI=1S/C84H145N3O29/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-36-38-40-42-44-46-48-66(98)87-58(59(94)47-45-43-41-39-37-35-18-16-14-12-10-8-6-2)55-109-79-73(103)72(102)75(65(54-91)111-79)112-80-74(104)78(70(100)63(52-89)110-80)116-84(82(107)108)50-61(96)68(86-57(4)93)77(115-84)71(101)64(53-90)113-83(81(105)106)49-60(95)67(85-56(3)92)76(114-83)69(99)62(97)51-88/h13,15,19-20,22-23,25-26,45,47,58-65,67-80,88-91,94-97,99-104H,5-12,14,16-18,21,24,27-44,46,48-55H2,1-4H3,(H,85,92)(H,86,93)(H,87,98)(H,105,106)(H,107,108)/p-2/b15-13-,20-19-,23-22-,26-25-,47-45+/t58-,59+,60-,61-,62+,63+,64+,65+,67+,68+,69+,70-,71+,72+,73+,74+,75+,76+,77+,78-,79+,80-,83+,84-/m0/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=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](O[C@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@@H](CO)O[C@]4(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph