Ganglioside GT1c (d18:1(4E)/iso13:0)

Properties Image Occurences in reactions MNX_ID MNXM525390 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C90H152N5O47 charge -3 mass 2054.96741 reference slm:000487345 InChIKey LMPYFICPQOJITF-DUHWHICFSA-K InChI InChI=1S/C90H155N5O47/c1-8-9-10-11-12-13-14-15-16-17-20-23-26-29-48(107)47(95-59(112)30-27-24-21-18-19-22-25-28-42(2)3)41-129-82-72(121)70(119)74(57(39-101)132-82)134-84-73(122)80(75(58(40-102)133-84)135-81-63(94-46(7)106)76(66(115)54(36-98)130-81)136-83-71(120)69(118)65(114)53(35-97)131-83)142-90(87(127)128)33-51(110)62(93-45(6)105)79(141-90)68(117)56(38-100)138-89(86(125)126)32-50(109)61(92-44(5)104)78(140-89)67(116)55(37-99)137-88(85(123)124)31-49(108)60(91-43(4)103)77(139-88)64(113)52(111)34-96/h26,29,42,47-58,60-84,96-102,107-111,113-122H,8-25,27-28,30-41H2,1-7H3,(H,91,103)(H,92,104)(H,93,105)(H,94,106)(H,95,112)(H,123,124)(H,125,126)(H,127,128)/p-3/b29-26+/t47-,48+,49-,50-,51-,52+,53+,54+,55+,56+,57+,58+,60+,61+,62+,63+,64+,65-,66-,67+,68+,69-,70+,71+,72+,73+,74+,75-,76+,77+,78+,79+,80+,81-,82+,83-,84-,88+,89+,90-/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@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](CO)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)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCC(C)C

Parent-child relations graph

Deprecated MNXref IDs graph