NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4(Fucalpha1-3)GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM27987 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C127H222N6O65 charge 0 mass 2871.42505 reference lipidmapsM:LMSP0601FL05 InChIKey ADGGBPADLPOAGX-VSJHBTOSSA-N InChI InChI=1S/C127H222N6O65/c1-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-78(153)133-64(65(150)43-41-39-37-35-33-31-22-20-18-16-14-12-10-2)57-175-119-97(167)95(165)106(76(55-143)186-119)190-123-99(169)111(87(157)69(48-136)179-123)194-116-81(130-61(6)147)91(161)103(73(52-140)183-116)187-121-98(168)110(86(156)68(47-135)177-121)193-115-80(129-60(5)146)92(162)104(74(53-141)182-115)188-122-100(170)113(89(159)70(49-137)178-122)196-118-83(132-63(8)149)109(192-120-96(166)94(164)84(154)58(3)176-120)107(77(56-144)185-118)191-124-101(171)112(88(158)71(50-138)180-124)195-117-82(131-62(7)148)93(163)105(75(54-142)184-117)189-125-102(172)114(90(160)72(51-139)181-125)198-127(126(173)174)45-66(151)79(128-59(4)145)108(197-127)85(155)67(152)46-134/h41,43,58,64-77,79-125,134-144,150-152,154-172H,9-40,42,44-57H2,1-8H3,(H,128,145)(H,129,146)(H,130,147)(H,131,148)(H,132,149)(H,133,153)(H,173,174)/b43-41+/t58?,64-,65+,66?,67+,68?,69?,70?,71?,72?,73?,74?,75?,76?,77?,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+,104+,105+,106+,107+,108?,109+,110-,111-,112-,113-,114-,115-,116-,117-,118-,119+,120+,121-,122-,123-,124-,125-,127-/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](O)[C@H](O[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@@H]9OC(CO)[C@@H](O[C@@H]%10OC(CO)[C@H](O)[C@H](O[C@]%11(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O%11)C%10O)[C@H](O)C9NC(C)=O)C8O)[C@H](O[C@H]8OC(C)[C@@H](O)C(O)[C@@H]8O)C7NC(C)=O)C6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph