Ganglioside GT1b (d18:1(4E)/12:0)

Properties Image Occurences in reactions MNX_ID MNXM525226 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C89H150N5O47 charge -3 mass 2040.95176 reference slm:000486389 InChIKey YBDLHLYSBSTCIP-NXHNWTTNSA-K InChI InChI=1S/C89H153N5O47/c1-7-9-11-13-15-17-18-19-20-22-23-25-27-29-47(106)46(94-58(112)30-28-26-24-21-16-14-12-10-8-2)41-128-81-69(119)68(118)72(56(39-100)131-81)133-83-71(121)79(141-89(86(126)127)33-50(109)61(92-44(5)104)77(139-89)67(117)55(38-99)136-87(84(122)123)31-48(107)59(90-42(3)102)75(137-87)63(113)51(110)34-95)73(57(40-101)132-83)134-80-62(93-45(6)105)74(65(115)53(36-97)129-80)135-82-70(120)78(66(116)54(37-98)130-82)140-88(85(124)125)32-49(108)60(91-43(4)103)76(138-88)64(114)52(111)35-96/h27,29,46-57,59-83,95-101,106-111,113-121H,7-26,28,30-41H2,1-6H3,(H,90,102)(H,91,103)(H,92,104)(H,93,105)(H,94,112)(H,122,123)(H,124,125)(H,126,127)/p-3/b29-27+/t46-,47+,48-,49-,50-,51+,52+,53+,54+,55+,56+,57+,59+,60+,61+,62+,63+,64+,65-,66-,67+,68+,69+,70+,71+,72+,73-,74+,75+,76+,77+,78-,79+,80-,81+,82-,83-,87+,88-,89-/m0/s1 SMILES CCCCCCCCCCCCC/C=C/[C@@H](O)[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@]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@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@@H](CO)O[C@]4(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph