GalNAcbeta1-3Galalpha1-3(NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM26965 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C93H166N4O41 charge 0 mass 1995.10275 reference lipidmapsM:LMSP0601GQ05 InChIKey AAZCJAIPXLMJNZ-CFIALVBOSA-N InChI InChI=1S/C93H166N4O41/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-64(110)97-54(55(107)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2)49-125-88-76(119)75(118)81(62(48-103)131-88)134-90-78(121)84(136-89-77(120)83(70(113)59(45-100)128-89)135-87-66(95-52(4)105)73(116)69(112)58(44-99)127-87)72(115)63(132-90)50-126-86-67(96-53(5)106)74(117)80(61(47-102)130-86)133-91-79(122)85(71(114)60(46-101)129-91)138-93(92(123)124)42-56(108)65(94-51(3)104)82(137-93)68(111)57(109)43-98/h38,40,54-63,65-91,98-103,107-109,111-122H,6-37,39,41-50H2,1-5H3,(H,94,104)(H,95,105)(H,96,106)(H,97,110)(H,123,124)/b40-38+/t54-,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]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(C)=O)C([C@H](O)[C@H](O)CO)O5)C4O)[C@H](O)C3NC(C)=O)[C@H](O)[C@H](O[C@H]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4NC(C)=O)C3O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph