NeuAcalpha2-3(GalNAcbeta1-4)Galbeta1-4GlcNAcbeta1-6(GalNAcbeta1-3Galalpha1-3)Galbeta1-4Glcbeta-Cer(d18:1/26:0)

Properties Image Occurences in reactions MNX_ID MNXM27966 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C103H183N5O46 charge 0 mass 2226.21342 reference lipidmapsM:LMSP0601GX06 InChIKey QTPGWSJGRLKYEF-FODFKYIKSA-N InChI InChI=1S/C103H183N5O46/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-70(123)108-59(60(120)43-41-39-37-35-33-31-20-18-16-14-12-10-8-2)53-139-98-84(133)83(132)89(67(51-114)145-98)149-100-86(135)93(152-99-85(134)92(78(127)65(49-112)143-99)151-97-73(106-57(5)118)81(130)77(126)64(48-111)142-97)79(128)69(147-100)54-140-95-74(107-58(6)119)82(131)88(66(50-113)144-95)148-101-87(136)94(90(68(52-115)146-101)150-96-72(105-56(4)117)80(129)76(125)63(47-110)141-96)154-103(102(137)138)45-61(121)71(104-55(3)116)91(153-103)75(124)62(122)46-109/h41,43,59-69,71-101,109-115,120-122,124-136H,7-40,42,44-54H2,1-6H3,(H,104,116)(H,105,117)(H,106,118)(H,107,119)(H,108,123)(H,137,138)/b43-41+/t59-,60+,61?,62+,63?,64?,65?,66?,67?,68?,69?,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-,103-/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[C@@H]4OC(CO)[C@H](O)[C@H](O)C4NC(C)=O)C3O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph