GalNAcbeta1-3Galalpha1-3Galalpha1-3Galalpha1-3Galalpha1-3Galalpha1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z))

Properties Image Occurences in reactions MNX_ID MNXM24253 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C100H178N2O48 charge 0 mass 2175.15491 reference lipidmapsM:LMSP0502AZ08 InChIKey GGCPXLYRELUFML-WWAGHNEDSA-N InChI InChI=1S/C100H178N2O48/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-64(114)102-53(54(113)40-38-36-34-32-30-28-17-15-13-11-9-7-5-2)51-133-93-76(125)74(123)84(62(49-110)141-93)143-94-77(126)75(124)85(63(50-111)142-94)144-95-79(128)87(68(117)57(44-105)135-95)146-97-81(130)89(70(119)59(46-107)137-97)148-99-83(132)91(72(121)61(48-109)139-99)150-100-82(131)90(71(120)60(47-108)140-100)149-98-80(129)88(69(118)58(45-106)138-98)147-96-78(127)86(67(116)56(43-104)136-96)145-92-65(101-52(3)112)73(122)66(115)55(42-103)134-92/h18-19,38,40,53-63,65-100,103-111,113,115-132H,4-17,20-37,39,41-51H2,1-3H3,(H,101,112)(H,102,114)/b19-18-,40-38+/t53-,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+/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]3OC(CO)[C@H](O)[C@H](O[C@H]4OC(CO)[C@H](O)[C@H](O[C@H]5OC(CO)[C@H](O)[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[C@@H]9OC(CO)[C@H](O)[C@H](O)C9NC(C)=O)C8O)C7O)C6O)C5O)C4O)C3O)[C@H](O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph