Ganglioside GM1b (d18:1(4E)/38:4(23Z,26Z,29Z,32Z))

Properties Image Occurences in reactions MNX_ID MNXM523606 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C93H162N3O31 charge -1 mass 1817.11978 reference slm:000486529 InChIKey BENZVXCUPNTLNT-HBVNJHLOSA-M InChI InChI=1S/C93H163N3O31/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-42-44-46-48-50-52-54-72(107)96-64(65(104)53-51-49-47-45-43-41-18-16-14-12-10-8-6-2)61-118-89-80(113)78(111)84(70(59-100)121-89)124-90-81(114)79(112)83(71(60-101)122-90)123-88-74(95-63(4)103)85(76(109)68(57-98)119-88)125-91-82(115)87(77(110)69(58-99)120-91)127-93(92(116)117)55-66(105)73(94-62(3)102)86(126-93)75(108)67(106)56-97/h13,15,19-20,22-23,25-26,51,53,64-71,73-91,97-101,104-106,108-115H,5-12,14,16-18,21,24,27-50,52,54-61H2,1-4H3,(H,94,102)(H,95,103)(H,96,107)(H,116,117)/p-1/b15-13-,20-19-,23-22-,26-25-,53-51+/t64-,65+,66-,67+,68+,69+,70+,71+,73+,74+,75+,76-,77-,78+,79+,80+,81+,82+,83-,84+,85+,86+,87-,88-,89+,90-,91-,93-/m0/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCCCC(=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@]5(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H]3NC(C)=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph