Ganglioside GM4 (d18:1(4E)/14:0)

Properties Image Occurences in reactions MNX_ID MNXM524030 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C49H89N2O16 charge -1 mass 961.62176 reference slm:000485893 InChIKey WAGRZWDYINZCOO-QWBCYKPOSA-M InChI InChI=1S/C49H90N2O16/c1-4-6-8-10-12-14-16-17-19-20-22-24-26-28-36(55)35(51-40(58)29-27-25-23-21-18-15-13-11-9-7-5-2)33-64-47-44(61)46(43(60)39(32-53)65-47)67-49(48(62)63)30-37(56)41(50-34(3)54)45(66-49)42(59)38(57)31-52/h26,28,35-39,41-47,52-53,55-57,59-61H,4-25,27,29-33H2,1-3H3,(H,50,54)(H,51,58)(H,62,63)/p-1/b28-26+/t35-,36+,37-,38+,39+,41+,42+,43-,44+,45+,46-,47+,49-/m0/s1 SMILES CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@]2(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O2)[C@H]1O)NC(=O)CCCCCCCCCCCCC

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