NeuGcalpha2-8NeuGcalpha2-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/22:0)

Properties Image Occurences in reactions MNX_ID MNXM29916 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C88H156N4O41 charge 0 mass 1925.0245 reference lipidmapsM:LMSP0601FG04 InChIKey VEMXJHGIOGOEBV-PLIMETFISA-N InChI InChI=1S/C88H156N4O41/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-25-27-29-31-33-35-37-60(106)90-50(51(102)36-34-32-30-28-26-24-17-15-13-11-9-7-5-2)48-122-82-72(115)71(114)76(59(45-98)126-82)128-83-73(116)79(67(110)55(41-94)123-83)129-81-65(89-49(3)101)70(113)75(58(44-97)125-81)127-84-74(117)80(68(111)56(42-95)124-84)133-88(86(120)121)39-53(104)64(92-62(108)47-100)78(132-88)69(112)57(43-96)130-87(85(118)119)38-52(103)63(91-61(107)46-99)77(131-87)66(109)54(105)40-93/h34,36,50-59,63-84,93-100,102-105,109-117H,4-33,35,37-48H2,1-3H3,(H,89,101)(H,90,106)(H,91,107)(H,92,108)(H,118,119)(H,120,121)/b36-34+/t50-,51+,52?,53?,54+,55?,56?,57+,58?,59?,63+,64+,65?,66+,67-,68-,69+,70+,71+,72?,73?,74?,75+,76+,77?,78?,79-,80-,81-,82+,83-,84-,87+,88-/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@]5(C(=O)O)CC(O)[C@@H](NC(=O)CO)C([C@H](O)[C@@H](CO)O[C@]6(C(=O)O)CC(O)[C@@H](NC(=O)CO)C([C@H](O)[C@H](O)CO)O6)O5)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph