Fucalpha2-3(Galbeta1-4)GlcNAcbeta1-6GalNAcbeta1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/22:0)

Properties Image Occurences in reactions MNX_ID MNXM27898 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C86H155N3O37 charge 0 mass 1822.03394 reference lipidmapsM:LMSP0502BI04 InChIKey CKHHGRNDMOKSCR-QEHJLROESA-N InChI InChI=1S/C86H155N3O37/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-58(98)89-50(51(97)38-36-34-32-30-28-26-19-17-15-13-11-9-7-2)45-113-83-71(109)68(106)74(54(42-92)119-83)123-85-72(110)69(107)75(55(43-93)120-85)124-86-73(111)78(64(102)53(41-91)117-86)126-82-59(87-48(4)95)65(103)63(101)57(121-82)46-114-81-60(88-49(5)96)77(122-79-67(105)61(99)47(3)115-80(79)112)76(56(44-94)118-81)125-84-70(108)66(104)62(100)52(40-90)116-84/h36,38,47,50-57,59-86,90-94,97,99-112H,6-35,37,39-46H2,1-5H3,(H,87,95)(H,88,96)(H,89,98)/b38-36+/t47?,50-,51+,52?,53?,54?,55?,56?,57?,59?,60?,61+,62-,63-,64-,65+,66-,67?,68+,69+,70?,71?,72?,73?,74+,75-,76+,77+,78-,79-,80+,81+,82-,83+,84-,85-,86-/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]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O)C6O)[C@H](O[C@H]6C(O)[C@H](O)C(C)O[C@H]6O)C5NC(C)=O)[C@H](O)[C@H](O)C4NC(C)=O)C3O)[C@H](O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph