NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-3(GlcNAcalpha1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM26057 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C121H212N6O60 charge 0 mass 2709.37223 reference lipidmapsM:LMSP0601GA05 InChIKey QLPYPWLDBQUDBQ-SXKAGDRLSA-N InChI InChI=1S/C121H212N6O60/c1-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-76(145)127-63(64(142)43-41-39-37-35-33-31-22-20-18-16-14-12-10-2)55-166-114-96(160)94(158)103(74(54-136)176-114)180-116-97(161)105(85(149)68(48-130)170-116)182-112-80(125-61(7)140)91(155)100(72(52-134)174-112)178-117-98(162)106(183-113-81(126-62(8)141)92(156)101(73(53-135)175-113)179-118-99(163)107(86(150)69(49-131)171-118)187-121(120(164)165)45-65(143)77(122-58(4)137)104(186-121)83(147)66(144)46-128)88(152)75(177-117)56-167-110-79(124-60(6)139)90(154)102(71(51-133)173-110)181-119-109(185-115-95(159)93(157)82(146)57(3)168-115)108(87(151)70(50-132)172-119)184-111-78(123-59(5)138)89(153)84(148)67(47-129)169-111/h41,43,57,63-75,77-119,128-136,142-144,146-163H,9-40,42,44-56H2,1-8H3,(H,122,137)(H,123,138)(H,124,139)(H,125,140)(H,126,141)(H,127,145)(H,164,165)/b43-41+/t57?,63-,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]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)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph