Ganglioside GD1a alpha (d18:1(4E)/26:6(8Z,11Z,14Z,17Z,20Z,23Z))

Properties Image Occurences in reactions MNX_ID MNXM522710 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C92H150N4O39 charge -2 mass 1934.98882 reference slm:000486202 InChIKey WEYGTHGVUIEZJR-PTMPWRCRSA-L InChI InChI=1S/C92H152N4O39/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-28-29-31-33-35-37-39-41-43-66(110)96-56(57(105)42-40-38-36-34-32-30-19-17-15-13-11-9-7-2)51-124-86-76(117)74(115)80(63(49-100)127-86)131-87-77(118)75(116)79(64(50-101)128-87)130-85-69(95-55(5)104)81(73(114)65(129-85)52-125-91(89(120)121)44-58(106)67(93-53(3)102)82(133-91)70(111)60(108)46-97)132-88-78(119)84(72(113)62(48-99)126-88)135-92(90(122)123)45-59(107)68(94-54(4)103)83(134-92)71(112)61(109)47-98/h8,10,14,16,20-21,23-24,26-27,29,31,40,42,56-65,67-88,97-101,105-109,111-119H,6-7,9,11-13,15,17-19,22,25,28,30,32-39,41,43-52H2,1-5H3,(H,93,102)(H,94,103)(H,95,104)(H,96,110)(H,120,121)(H,122,123)/p-2/b10-8-,16-14-,21-20-,24-23-,27-26-,31-29-,42-40+/t56-,57+,58-,59-,60+,61+,62+,63+,64+,65+,67+,68+,69+,70+,71+,72-,73-,74+,75+,76+,77+,78+,79-,80+,81+,82+,83+,84-,85-,86+,87-,88-,91+,92-/m0/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=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@]4(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O4)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[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