Ganglioside GD2 (d18:1(4E)/15:0)

Properties Image Occurences in reactions MNX_ID MNXM522917 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C75H130N4O34 charge -2 mass 1630.85774 reference slm:000487727 InChIKey SQXBGEJHKSSWHX-AWYNPDGESA-L InChI InChI=1S/C75H132N4O34/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-45(88)44(79-53(92)32-30-28-26-24-22-19-17-15-13-11-9-7-2)40-104-70-62(98)61(97)64(51(38-83)106-70)108-71-63(99)68(65(52(39-84)107-71)109-69-56(78-43(5)87)60(96)58(94)49(36-81)105-69)113-75(73(102)103)34-47(90)55(77-42(4)86)67(112-75)59(95)50(37-82)110-74(72(100)101)33-46(89)54(76-41(3)85)66(111-74)57(93)48(91)35-80/h29,31,44-52,54-71,80-84,88-91,93-99H,6-28,30,32-40H2,1-5H3,(H,76,85)(H,77,86)(H,78,87)(H,79,92)(H,100,101)(H,102,103)/p-2/b31-29+/t44-,45+,46-,47-,48+,49+,50+,51+,52+,54+,55+,56+,57+,58-,59+,60+,61+,62+,63+,64+,65-,66+,67+,68+,69-,70+,71-,74+,75-/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]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)CCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph