Neu5Ac)GD1a(d18:1/26:1(17Z))

Properties Image Occurences in reactions MNX_ID MNXM29923 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C90H159N3O39 charge 0 mass 1906.05507 reference lipidmapsM:LMSP0601CB08 InChIKey CCZDLGNADPSHHA-UUGIBGTFSA-N InChI InChI=1S/C90H159N3O39/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-64(107)93-54(55(102)41-39-37-35-33-31-29-18-16-14-12-10-8-6-2)51-121-84-73(114)72(113)76(62(49-98)124-84)126-86-75(116)82(132-89(87(117)118)43-56(103)65(91-52(3)100)79(129-89)68(109)58(105)45-94)77(63(50-99)125-86)127-83-66(92-53(4)101)78(70(111)60(47-96)122-83)128-85-74(115)81(71(112)61(48-97)123-85)131-90(88(119)120)44-57(104)67(108)80(130-90)69(110)59(106)46-95/h19-20,39,41,54-63,65-86,94-99,102-106,108-116H,5-18,21-38,40,42-51H2,1-4H3,(H,91,100)(H,92,101)(H,93,107)(H,117,118)(H,119,120)/b20-19-,41-39+/t54-,55+,56?,57?,58+,59+,60?,61?,62?,63?,65+,66?,67+,68+,69+,70-,71-,72+,73?,74?,75?,76+,77-,78+,79?,80?,81-,82+,83-,84+,85-,86-,89-,90-/m0/s1 SMILES CCCCCCCC/C=C\CCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O[C@@H]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@]5(C(=O)O)CC(O)[C@@H](O)C([C@H](O)[C@H](O)CO)O5)C4O)C3NC(C)=O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O3)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph