Galalpha1-3(Fucalpha1-2)Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/16:0)

Properties Image Occurences in reactions MNX_ID MNXM29313 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C83H147N3O40 charge 0 mass 1825.95609 reference lipidmapsM:LMSP0601CY01 InChIKey OBMQIJOTMLBLNK-RKINIOHUSA-N InChI InChI=1S/C83H147N3O40/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-46(95)45(86-54(98)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)41-113-77-67(109)64(106)69(52(39-91)118-77)120-80-68(110)74(126-83(82(111)112)34-47(96)55(84-43(4)93)72(125-83)58(100)48(97)35-87)70(53(40-92)119-80)121-76-56(85-44(5)94)71(60(102)50(37-89)115-76)122-81-75(124-78-65(107)62(104)57(99)42(3)114-78)73(61(103)51(38-90)117-81)123-79-66(108)63(105)59(101)49(36-88)116-79/h30,32,42,45-53,55-81,87-92,95-97,99-110H,6-29,31,33-41H2,1-5H3,(H,84,93)(H,85,94)(H,86,98)(H,111,112)/b32-30+/t42?,45-,46+,47?,48+,49?,50?,51?,52?,53?,55+,56?,57+,58+,59-,60-,61-,62?,63-,64+,65-,66?,67?,68?,69+,70-,71+,72?,73-,74+,75?,76-,77+,78+,79+,80-,81-,83-/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](O)CO)O3)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph