X4 ganglioside(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM29953 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C121H211N5O63 charge 0 mass 2742.34607 reference lipidmapsM:LMSP0601FW03 InChIKey KQRONRRNUJWMSB-XEOPFZSESA-N InChI InChI=1S/C121H211N5O63/c1-10-12-14-16-18-20-22-24-25-26-27-29-31-33-35-37-39-41-72(143)126-60(61(140)40-38-36-34-32-30-28-23-21-19-17-15-13-11-2)52-166-112-92(159)88(155)97(68(48-132)177-112)178-116-93(160)105(81(148)64(44-128)170-116)185-109-74(123-57(7)137)102(182-113-89(156)85(152)77(144)53(3)167-113)98(69(49-133)174-109)179-117-94(161)106(82(149)65(45-129)171-117)186-110-75(124-58(8)138)103(183-114-90(157)86(153)78(145)54(4)168-114)99(70(50-134)175-110)180-118-95(162)107(83(150)66(46-130)172-118)187-111-76(125-59(9)139)104(184-115-91(158)87(154)79(146)55(5)169-115)100(71(51-135)176-111)181-119-96(163)108(84(151)67(47-131)173-119)189-121(120(164)165)42-62(141)73(122-56(6)136)101(188-121)80(147)63(142)43-127/h38,40,53-55,60-71,73-119,127-135,140-142,144-163H,10-37,39,41-52H2,1-9H3,(H,122,136)(H,123,137)(H,124,138)(H,125,139)(H,126,143)(H,164,165)/b40-38+/t53?,54?,55?,60-,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-,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[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)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)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph