NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-3(GlcNAcalpha1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z))

Properties Image Occurences in reactions MNX_ID MNXM26252 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C123H214N6O60 charge 0 mass 2735.38788 reference lipidmapsM:LMSP0601GA08 InChIKey XZKYOAXQYIDUHC-UGKRGTRBSA-N InChI InChI=1S/C123H214N6O60/c1-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-36-38-40-42-44-46-78(147)129-65(66(144)45-43-41-39-37-35-33-22-20-18-16-14-12-10-2)57-168-116-98(162)96(160)105(76(56-138)178-116)182-118-99(163)107(87(151)70(50-132)172-118)184-114-82(127-63(7)142)93(157)102(74(54-136)176-114)180-119-100(164)108(185-115-83(128-64(8)143)94(158)103(75(55-137)177-115)181-120-101(165)109(88(152)71(51-133)173-120)189-123(122(166)167)47-67(145)79(124-60(4)139)106(188-123)85(149)68(146)48-130)90(154)77(179-119)58-169-112-81(126-62(6)141)92(156)104(73(53-135)175-112)183-121-111(187-117-97(161)95(159)84(148)59(3)170-117)110(89(153)72(52-134)174-121)186-113-80(125-61(5)140)91(155)86(150)69(49-131)171-113/h23-24,43,45,59,65-77,79-121,130-138,144-146,148-165H,9-22,25-42,44,46-58H2,1-8H3,(H,124,139)(H,125,140)(H,126,141)(H,127,142)(H,128,143)(H,129,147)(H,166,167)/b24-23-,45-43+/t59?,65-,66+,67?,68+,69?,70?,71?,72?,73?,74?,75?,76?,77?,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-,120-,121-,123-/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](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[C@@H]7OC(CO)[C@@H](O)[C@H](O)C7NC(C)=O)C6O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O)C5NC(C)=O)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@]7(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O7)C6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph