Galbeta1-3GalNAcalpha1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z))

Properties Image Occurences in reactions MNX_ID MNXM23734 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C104H184N4O47 charge 0 mass 2241.21309 reference lipidmapsM:LMSP0505AW08 InChIKey MFEAFRDZSIDYDD-PHZOICACSA-N InChI InChI=1S/C104H184N4O47/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-68(121)108-58(59(120)43-41-39-37-35-33-31-20-18-16-14-12-10-8-2)53-138-99-85(135)82(132)90(67(52-116)147-99)149-103-87(137)93(76(126)63(48-112)143-103)153-96-69(105-55(4)117)78(128)88(65(50-114)145-96)148-102-86(136)92(75(125)62(47-111)142-102)152-97-70(106-56(5)118)79(129)89(66(51-115)146-97)150-104-95(155-100-83(133)80(130)72(122)54(3)139-100)94(77(127)64(49-113)144-104)154-98-71(107-57(6)119)91(74(124)61(46-110)140-98)151-101-84(134)81(131)73(123)60(45-109)141-101/h21-22,41,43,54,58-67,69-104,109-116,120,122-137H,7-20,23-40,42,44-53H2,1-6H3,(H,105,117)(H,106,118)(H,107,119)(H,108,121)/b22-21-,43-41+/t54?,58-,59+,60?,61?,62?,63?,64?,65?,66?,67?,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-/m0/s1 SMILES CCCCCCCC/C=C\CCCCCCCCCCCCCCCC(=O)N[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](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[C@@H]8OC(CO)[C@H](O)[C@H](O)C8O)C7NC(C)=O)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)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph