Ganglioside GM1(NeuGc) (d18:0/32:5(17Z,20Z,23Z,26Z,29Z))

Properties Image Occurences in reactions MNX_ID MNXM1076501 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C87H150N3O32 charge -1 mass 1749.02079 reference slm:000769704 InChIKey JRMVDAHAUYYEPN-XMLZLTCLSA-M InChI InChI=1S/C87H151N3O32/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-35-37-39-41-43-45-47-65(101)89-57(58(98)46-44-42-40-38-36-34-17-15-13-11-9-7-5-2)55-113-83-75(109)73(107)77(63(52-94)116-83)118-85-76(110)81(122-87(86(111)112)48-59(99)67(90-66(102)54-96)80(121-87)69(103)60(100)49-91)78(64(53-95)117-85)119-82-68(88-56(3)97)79(71(105)62(51-93)114-82)120-84-74(108)72(106)70(104)61(50-92)115-84/h6,8,12,14,18-19,21-22,24-25,57-64,67-85,91-96,98-100,103-110H,4-5,7,9-11,13,15-17,20,23,26-55H2,1-3H3,(H,88,97)(H,89,101)(H,90,102)(H,111,112)/p-1/b8-6-,14-12-,19-18-,22-21-,25-24-/t57-,58+,59-,60+,61+,62+,63+,64+,67+,68+,69+,70-,71-,72-,73+,74+,75+,76+,77+,78-,79+,80+,81+,82-,83+,84-,85-,87-/m0/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=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(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O3)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph