Ganglioside GD3 (d18:1(4E)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Properties Image Occurences in reactions MNX_ID MNXM523155 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C74H119N3O29 charge -2 mass 1513.79402 reference slm:000487040 InChIKey BZMBKGGLZHNYBV-PLLNTZBXSA-L InChI InChI=1S/C74H121N3O29/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-56(88)77-48(49(84)37-35-33-31-29-27-25-18-16-14-12-10-8-6-2)45-99-69-63(93)62(92)65(55(44-81)101-69)102-70-64(94)68(60(90)53(42-79)100-70)106-74(72(97)98)40-51(86)58(76-47(4)83)67(105-74)61(91)54(43-80)103-73(71(95)96)39-50(85)57(75-46(3)82)66(104-73)59(89)52(87)41-78/h7,9,13,15,19-20,22-23,26,28,32,34-35,37,48-55,57-70,78-81,84-87,89-94H,5-6,8,10-12,14,16-18,21,24-25,27,29-31,33,36,38-45H2,1-4H3,(H,75,82)(H,76,83)(H,77,88)(H,95,96)(H,97,98)/p-2/b9-7-,15-13-,20-19-,23-22-,28-26-,34-32-,37-35+/t48-,49+,50-,51-,52+,53+,54+,55+,57+,58+,59+,60-,61+,62+,63+,64+,65+,66+,67+,68-,69+,70-,73+,74-/m0/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=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