Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-3GalNAcbeta1-4Galbeta1-4Glcbeta-Cer(d18:1/18:0)

Properties Image Occurences in reactions MNX_ID MNXM23078 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C87H154N4O41 charge 0 mass 1911.00885 reference lipidmapsM:LMSP0601BB02 InChIKey LWMYFFZGBGWYQE-IKFCVILBSA-N InChI InChI=1S/C87H154N4O41/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-58(105)91-48(49(102)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2)44-119-82-70(114)67(111)74(55(41-96)123-82)127-84-71(115)68(112)73(56(42-97)124-84)126-80-60(89-46(4)100)77(65(109)53(39-94)120-80)130-85-72(116)79(132-87(86(117)118)36-50(103)59(88-45(3)99)78(131-87)62(106)51(104)37-92)75(57(43-98)125-85)128-81-61(90-47(5)101)76(64(108)54(40-95)121-81)129-83-69(113)66(110)63(107)52(38-93)122-83/h32,34,48-57,59-85,92-98,102-104,106-116H,6-31,33,35-44H2,1-5H3,(H,88,99)(H,89,100)(H,90,101)(H,91,105)(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](O[C@@H]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O[C@@H]5OC(CO)[C@H](O)[C@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O)C6O)C5NC(C)=O)[C@H](O[C@]5(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)C4O)C3NC(C)=O)[C@H](O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph