X3 ganglioside(d18:1/26:0)

Properties Image Occurences in reactions MNX_ID MNXM27135 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C121H213N5O59 charge 0 mass 2680.38206 reference lipidmapsM:LMSP0601FV06 InChIKey AHRFTWCWFFDDCZ-BGVDFUNDSA-N InChI InChI=1S/C121H213N5O59/c1-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-44-46-76(143)126-64(65(140)45-43-41-39-37-35-33-22-20-18-16-14-12-10-2)57-164-113-94(157)91(154)100(73(54-133)174-113)176-117-96(159)108(86(149)69(50-129)168-117)183-111-79(124-62(7)138)104(179-114-92(155)89(152)81(144)58(3)165-114)101(74(55-134)172-111)177-118-97(160)106(84(147)70(51-130)169-118)181-110-78(123-61(6)137)88(151)99(72(53-132)171-110)175-116-95(158)107(85(148)68(49-128)167-116)182-112-80(125-63(8)139)105(180-115-93(156)90(153)82(145)59(4)166-115)102(75(56-135)173-112)178-119-98(161)109(87(150)71(52-131)170-119)185-121(120(162)163)47-66(141)77(122-60(5)136)103(184-121)83(146)67(142)48-127/h43,45,58-59,64-75,77-119,127-135,140-142,144-161H,9-42,44,46-57H2,1-8H3,(H,122,136)(H,123,137)(H,124,138)(H,125,139)(H,126,143)(H,162,163)/b45-43+/t58?,59?,64-,65+,66?,67+,68?,69?,70?,71?,72?,73?,74?,75?,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-,109-,110-,111-,112-,113+,114+,115+,116-,117-,118-,119-,121-/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](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]8OC(CO)[C@H](O)[C@H](O[C@]9(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O9)C8O)[C@H](O[C@H]8OC(C)[C@@H](O)C(O)[C@@H]8O)C7NC(C)=O)C6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O[C@H]4OC(C)[C@@H](O)C(O)[C@@H]4O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph