GalNAcalpha1-3GalNAcbeta1-3Galalpha1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/16:0)

Properties Image Occurences in reactions MNX_ID MNXM24150 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C82H146N4O38 charge 0 mass 1794.96151 reference lipidmapsM:LMSP0506AI01 InChIKey RKBYDGMFVVJATH-IUWBTKNSSA-N InChI InChI=1S/C82H146N4O38/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-46(96)45(86-54(97)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)40-111-79-68(108)66(106)72(52(39-92)118-79)121-82-70(110)75(62(102)53(119-82)41-112-76-56(84-43(4)94)64(104)71(51(38-91)117-76)120-80-67(107)65(105)59(99)48(35-88)115-80)124-81-69(109)74(61(101)50(37-90)116-81)123-78-57(85-44(5)95)73(60(100)49(36-89)114-78)122-77-55(83-42(3)93)63(103)58(98)47(34-87)113-77/h30,32,45-53,55-82,87-92,96,98-110H,6-29,31,33-41H2,1-5H3,(H,83,93)(H,84,94)(H,85,95)(H,86,97)/b32-30+/t45-,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+,82-/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)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[C@H]5OC(CO)[C@H](O)[C@H](O)C5NC(C)=O)C4NC(C)=O)C3O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph