Ganglioside GT1c (d18:1(4E)/34:6(16Z,19Z,22Z,25Z,28Z,31Z))

Properties Image Occurences in reactions MNX_ID MNXM525378 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C111H182N5O47 charge -3 mass 2337.20216 reference slm:000487365 InChIKey XWAIPBDAUSWALU-PIUDJCQQSA-K InChI InChI=1S/C111H185N5O47/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-80(133)116-68(69(128)51-49-47-45-43-41-39-20-18-16-14-12-10-8-2)63-150-103-93(142)91(140)95(78(61-122)153-103)155-105-94(143)101(96(79(62-123)154-105)156-102-84(115-67(6)127)97(87(136)75(58-119)151-102)157-104-92(141)90(139)86(135)74(57-118)152-104)163-111(108(148)149)55-72(131)83(114-66(5)126)100(162-111)89(138)77(60-121)159-110(107(146)147)54-71(130)82(113-65(4)125)99(161-110)88(137)76(59-120)158-109(106(144)145)53-70(129)81(112-64(3)124)98(160-109)85(134)73(132)56-117/h9,11,15,17,21-22,24-25,27-28,30-31,49,51,68-79,81-105,117-123,128-132,134-143H,7-8,10,12-14,16,18-20,23,26,29,32-48,50,52-63H2,1-6H3,(H,112,124)(H,113,125)(H,114,126)(H,115,127)(H,116,133)(H,144,145)(H,146,147)(H,148,149)/p-3/b11-9-,17-15-,22-21-,25-24-,28-27-,31-30-,51-49+/t68-,69+,70-,71-,72-,73+,74+,75+,76+,77+,78+,79+,81+,82+,83+,84+,85+,86-,87-,88+,89+,90-,91+,92+,93+,94+,95+,96-,97+,98+,99+,100+,101+,102-,103+,104-,105-,109+,110+,111-/m0/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCC(=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]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)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph