Galalpha1-3(NeuAcalpha2-3(GalNAcbeta1-4)Galbeta1-4GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/16:0)

Properties Image Occurences in reactions MNX_ID MNXM25671 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C85H150N4O41 charge 0 mass 1882.97755 reference lipidmapsM:LMSP0601GR01 InChIKey ZVXHQNSYFASESF-KMBSSRTFSA-N InChI InChI=1S/C85H150N4O41/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-47(99)46(89-56(102)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)41-117-80-69(112)67(110)73(53(39-94)122-80)126-82-70(113)76(128-81-68(111)66(109)62(105)51(37-92)120-81)63(106)55(124-82)42-118-78-59(88-45(5)98)65(108)72(52(38-93)121-78)125-83-71(114)77(74(54(40-95)123-83)127-79-58(87-44(4)97)64(107)61(104)50(36-91)119-79)130-85(84(115)116)34-48(100)57(86-43(3)96)75(129-85)60(103)49(101)35-90/h30,32,46-55,57-83,90-95,99-101,103-114H,6-29,31,33-42H2,1-5H3,(H,86,96)(H,87,97)(H,88,98)(H,89,102)(H,115,116)/b32-30+/t46-,47+,48?,49+,50?,51?,52?,53?,54?,55?,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-,83-,85-/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]5OC(CO)[C@H](O)[C@H](O)C5NC(C)=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)C3O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph