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

Properties Image Occurences in reactions MNX_ID MNXM29932 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C108H190N4O57 charge 0 mass 2455.20919 reference lipidmapsM:LMSP0505EA02 InChIKey YFRYXPOCKYWYIT-KUCBFKGWSA-N InChI InChI=1S/C108H190N4O57/c1-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-64(126)112-52(53(125)35-33-31-29-27-25-23-20-18-16-14-12-10-8-2)46-148-101-85(144)81(140)92(62(45-121)159-101)163-106-86(145)93(71(130)56(39-115)154-106)165-99-66(110-50(5)123)76(135)90(60(43-119)157-99)162-107-88(147)95(74(133)63(160-107)47-149-98-65(109-49(4)122)75(134)89(59(42-118)156-98)161-105-87(146)94(72(131)57(40-116)153-105)167-103-83(142)79(138)69(128)54(37-113)151-103)166-100-67(111-51(6)124)77(136)91(61(44-120)158-100)164-108-97(169-102-82(141)78(137)68(127)48(3)150-102)96(73(132)58(41-117)155-108)168-104-84(143)80(139)70(129)55(38-114)152-104/h33,35,48,52-63,65-108,113-121,125,127-147H,7-32,34,36-47H2,1-6H3,(H,109,122)(H,110,123)(H,111,124)(H,112,126)/b35-33+/t48?,52-,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[C@@H]7OC(CO)[C@H](O)[C@H](O)C7O)C6O)[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