NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-3(Galx1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-6}Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/16:0)

Properties Image Occurences in reactions MNX_ID MNXM25517 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C105H183N5O55 charge 0 mass 2394.16765 reference lipidmapsM:LMSP0601FC01 InChIKey PZTDXEUXRPZAPZ-NOXNNXMNSA-N InChI InChI=1S/C105H183N5O55/c1-8-10-12-14-16-18-20-22-24-26-28-30-32-34-53(123)52(110-64(126)35-33-31-29-27-25-23-21-19-17-15-13-11-9-2)45-146-98-83(141)80(138)89(62(44-118)155-98)159-101-84(142)91(72(130)56(38-112)149-101)161-96-67(108-50(6)121)76(134)86(60(42-116)153-96)157-100-82(140)79(137)71(129)63(156-100)46-147-95-66(107-49(5)120)75(133)88(59(41-115)152-95)160-103-94(163-99-81(139)78(136)69(127)47(3)148-99)93(74(132)58(40-114)151-103)162-97-68(109-51(7)122)77(135)87(61(43-117)154-97)158-102-85(143)92(73(131)57(39-113)150-102)165-105(104(144)145)36-54(124)65(106-48(4)119)90(164-105)70(128)55(125)37-111/h32,34,47,52-63,65-103,111-118,123-125,127-143H,8-31,33,35-46H2,1-7H3,(H,106,119)(H,107,120)(H,108,121)(H,109,122)(H,110,126)(H,144,145)/b34-32+/t47?,52-,53+,54?,55+,56?,57?,58?,59?,60?,61?,62?,63?,65+,66?,67?,68?,69+,70+,71-,72-,73-,74-,75+,76+,77+,78?,79-,80+,81-,82?,83?,84?,85?,86+,87+,88+,89+,90?,91-,92-,93-,94?,95+,96-,97-,98+,99+,100-,101-,102-,103-,105-/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](O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@@H]7OC(CO)[C@@H](O[C@@H]8OC(CO)[C@H](O)[C@H](O[C@]9(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O9)C8O)[C@H](O)C7NC(C)=O)C6O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O)C5NC(C)=O)[C@H](O)[C@H](O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph