Ganglioside GA1 (d18:1(4E)/26:4(11Z,14Z,17Z,20Z))

Properties Image Occurences in reactions MNX_ID MNXM521879 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C70H122N2O23 charge 0 mass 1358.84384 reference slm:000487432 InChIKey MWZRFIOSTWGHTD-YZMGVPFKSA-N InChI InChI=1S/C70H122N2O23/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-54(79)72-48(49(78)40-38-36-34-32-30-28-17-15-13-11-9-7-5-2)46-88-68-62(86)59(83)65(52(44-75)91-68)94-70-63(87)60(84)64(53(45-76)92-70)93-67-55(71-47(3)77)66(57(81)51(43-74)89-67)95-69-61(85)58(82)56(80)50(42-73)90-69/h12,14,18-19,21-22,24-25,38,40,48-53,55-70,73-76,78,80-87H,4-11,13,15-17,20,23,26-37,39,41-46H2,1-3H3,(H,71,77)(H,72,79)/b14-12-,19-18-,22-21-,25-24-,40-38+/t48-,49+,50+,51+,52+,53+,55+,56-,57-,58-,59+,60+,61+,62+,63+,64-,65+,66+,67-,68+,69-,70-/m0/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=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