Ganglioside GA1 (d18:1(4E)/22:4(7Z,10Z,13Z,16Z))

Properties Image Occurences in reactions MNX_ID MNXM521866 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C66H114N2O23 charge 0 mass 1302.78124 reference slm:000487475 InChIKey JAHULHLQUPKOCN-DXTYCADRSA-N InChI InChI=1S/C66H114N2O23/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-25-27-29-31-33-35-37-50(75)68-44(45(74)36-34-32-30-28-26-24-17-15-13-11-9-7-5-2)42-84-64-58(82)55(79)61(48(40-71)87-64)90-66-59(83)56(80)60(49(41-72)88-66)89-63-51(67-43(3)73)62(53(77)47(39-70)85-63)91-65-57(81)54(78)52(76)46(38-69)86-65/h12,14,18-19,21-22,25,27,34,36,44-49,51-66,69-72,74,76-83H,4-11,13,15-17,20,23-24,26,28-33,35,37-42H2,1-3H3,(H,67,73)(H,68,75)/b14-12-,19-18-,22-21-,27-25-,36-34+/t44-,45+,46+,47+,48+,49+,51+,52-,53-,54-,55+,56+,57+,58+,59+,60-,61+,62+,63-,64+,65-,66-/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]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3NC(C)=O)[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