Ganglioside GM2 (d18:1(4E)/22:3(10Z,13Z,16Z))

Properties Image Occurences in reactions MNX_ID MNXM523650 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C71H122N3O26 charge -1 mass 1432.8322 reference slm:000487567 InChIKey ZJLNGCXMUVRVLM-FXJKEUMBSA-M InChI InChI=1S/C71H123N3O26/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-54(84)74-47(48(81)37-35-33-31-29-27-25-18-16-14-12-10-8-6-2)44-93-68-61(89)60(88)63(52(42-77)95-68)97-69-62(90)66(64(53(43-78)96-69)98-67-56(73-46(4)80)59(87)58(86)51(41-76)94-67)100-71(70(91)92)39-49(82)55(72-45(3)79)65(99-71)57(85)50(83)40-75/h13,15,19-20,22-23,35,37,47-53,55-69,75-78,81-83,85-90H,5-12,14,16-18,21,24-34,36,38-44H2,1-4H3,(H,72,79)(H,73,80)(H,74,84)(H,91,92)/p-1/b15-13-,20-19-,23-22-,37-35+/t47-,48+,49-,50+,51+,52+,53+,55+,56+,57+,58-,59+,60+,61+,62+,63+,64-,65+,66+,67-,68+,69-,71-/m0/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=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]3NC(C)=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](O)CO)O3)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph