Galalpha1-3(Fucalpha1-2)Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM27307 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C98H172N4O48 charge 0 mass 2173.1141 reference lipidmapsM:LMSP0601CM03 InChIKey VMDKUVSNXLIPHA-YXXLZYQJSA-N InChI InChI=1S/C98H172N4O48/c1-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-64(117)102-53(54(113)37-35-33-31-29-27-25-20-18-16-14-12-10-8-2)48-135-90-79(129)76(126)81(62(46-108)140-90)142-93-80(130)87(150-98(96(133)134)40-56(115)66(100-51(5)111)85(149-98)73(123)61(45-107)147-97(95(131)132)39-55(114)65(99-50(4)110)84(148-97)69(119)57(116)41-103)82(63(47-109)141-93)143-89-67(101-52(6)112)83(71(121)59(43-105)137-89)144-94-88(146-91-77(127)74(124)68(118)49(3)136-91)86(72(122)60(44-106)139-94)145-92-78(128)75(125)70(120)58(42-104)138-92/h35,37,49,53-63,65-94,103-109,113-116,118-130H,7-34,36,38-48H2,1-6H3,(H,99,110)(H,100,111)(H,101,112)(H,102,117)(H,131,132)(H,133,134)/b37-35+/t49?,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-,97+,98-/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)C5O)C4O[C@H]4OC(C)[C@@H](O)C(O)[C@@H]4O)C3NC(C)=O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@@H](CO)O[C@]4(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O4)O3)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph