NeuAcalpha2-6Galbeta1-4GlcNAcbeta1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/18:0)

Properties Image Occurences in reactions MNX_ID MNXM25515 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C87H154N4O41 charge 0 mass 1911.00885 reference lipidmapsM:LMSP0601FE02 InChIKey YHHCNTWSLPAUIV-HANBCGSNSA-N InChI InChI=1S/C87H154N4O41/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-58(103)91-48(49(100)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2)42-119-82-73(115)70(112)77(55(41-96)125-82)130-85-74(116)79(65(107)56(126-85)43-120-80-60(89-46(4)98)66(108)75(53(39-94)123-80)128-83-71(113)68(110)63(105)52(38-93)122-83)131-81-61(90-47(5)99)67(109)76(54(40-95)124-81)129-84-72(114)69(111)64(106)57(127-84)44-121-87(86(117)118)36-50(101)59(88-45(3)97)78(132-87)62(104)51(102)37-92/h32,34,48-57,59-85,92-96,100-102,104-116H,6-31,33,35-44H2,1-5H3,(H,88,97)(H,89,98)(H,90,99)(H,91,103)(H,117,118)/b34-32+/t48-,49+,50?,51+,52?,53?,54?,55?,56?,57?,59+,60?,61?,62+,63-,64-,65-,66+,67+,68-,69-,70+,71?,72?,73?,74?,75+,76+,77+,78?,79-,80+,81-,82+,83-,84-,85-,87+/m0/s1 SMILES CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4O)[C@H](O)C3NC(C)=O)[C@H](O)[C@H](O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO[C@]5(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)[C@H](O)[C@H](O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph