Fucalpha1-3GlcNAcbeta1-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM27012 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C93H166N4O40 charge 0 mass 1979.10784 reference lipidmapsM:LMSP0601BT05 InChIKey BQNCDBPRHMROHJ-COJPLASHSA-N InChI InChI=1S/C93H166N4O40/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-64(110)97-55(56(107)41-39-37-35-33-31-29-20-18-16-14-12-10-8-2)50-124-88-76(119)74(117)79(62(48-102)129-88)131-91-78(121)85(137-93(92(122)123)43-57(108)65(94-52(4)104)83(136-93)69(112)58(109)44-98)80(63(49-103)130-91)132-86-66(95-53(5)105)82(71(114)59(45-99)126-86)134-90-77(120)84(72(115)61(47-101)128-90)135-87-67(96-54(6)106)81(70(113)60(46-100)127-87)133-89-75(118)73(116)68(111)51(3)125-89/h39,41,51,55-63,65-91,98-103,107-109,111-121H,7-38,40,42-50H2,1-6H3,(H,94,104)(H,95,105)(H,96,106)(H,97,110)(H,122,123)/b41-39+/t51?,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-,93-/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](O[C@@H]5OC(CO)[C@@H](O)[C@H](O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)C5NC(C)=O)C4O)C3NC(C)=O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O3)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph