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

Properties Image Occurences in reactions MNX_ID MNXM27397 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C109H193N5O51 charge 0 mass 2388.26625 reference lipidmapsM:LMSP0601ER06 InChIKey VGWODQJQKKQMTK-XLEGCVLDSA-N InChI InChI=1S/C109H193N5O51/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-72(129)114-60(61(126)43-41-39-37-35-33-31-20-18-16-14-12-10-8-2)53-148-103-90(143)87(140)96(69(52-121)156-103)162-106-91(144)98(80(133)65(48-117)152-106)163-101-76(113-59(6)125)84(137)95(68(51-120)155-101)161-107-92(145)99(81(134)70(157-107)54-149-100-74(111-57(4)123)82(135)93(66(49-118)153-100)159-104-88(141)85(138)78(131)64(47-116)151-104)164-102-75(112-58(5)124)83(136)94(67(50-119)154-102)160-105-89(142)86(139)79(132)71(158-105)55-150-109(108(146)147)45-62(127)73(110-56(3)122)97(165-109)77(130)63(128)46-115/h41,43,60-71,73-107,115-121,126-128,130-145H,7-40,42,44-55H2,1-6H3,(H,110,122)(H,111,123)(H,112,124)(H,113,125)(H,114,129)(H,146,147)/b43-41+/t60-,61+,62?,63+,64?,65?,66?,67?,68?,69?,70?,71?,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-,109+/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](O)C5NC(C)=O)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO[C@]7(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O7)[C@H](O)[C@H](O)C6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph