Fucalpha1-2(Galalpha1-3)Galbeta1-4GlcNAcbeta1-3(Fucalpha1-2Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/18:0)

Properties Image Occurences in reactions MNX_ID MNXM28621 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C108H190N4O56 charge 0 mass 2439.21427 reference lipidmapsM:LMSP0505EB02 InChIKey QYGRFPOQOBSKSZ-WZOUWBHPSA-N InChI InChI=1S/C108H190N4O56/c1-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-64(125)112-53(54(124)36-34-32-30-28-26-24-21-19-17-15-13-11-9-2)46-147-101-86(144)82(140)92(62(45-120)158-101)161-105-87(145)93(72(130)57(40-115)152-105)164-99-66(110-51(6)122)76(134)89(60(43-118)156-99)160-106-88(146)94(74(132)63(159-106)47-148-98-65(109-50(5)121)75(133)90(59(42-117)155-98)162-107-96(81(139)71(129)56(39-114)153-107)167-102-83(141)78(136)68(126)48(3)149-102)165-100-67(111-52(7)123)77(135)91(61(44-119)157-100)163-108-97(168-103-84(142)79(137)69(127)49(4)150-103)95(73(131)58(41-116)154-108)166-104-85(143)80(138)70(128)55(38-113)151-104/h34,36,48-49,53-63,65-108,113-120,124,126-146H,8-33,35,37-47H2,1-7H3,(H,109,121)(H,110,122)(H,111,123)(H,112,125)/b36-34+/t48?,49?,53-,54+,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+,92+,93-,94-,95-,96?,97?,98+,99-,100-,101+,102+,103+,104-,105-,106-,107-,108-/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](O[C@@H]3OC(CO)[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]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O)C5NC(C)=O)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@@H]7OC(CO)[C@H](O)[C@H](O)C7O)C6O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph