NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-3(Galalpha1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z))

Properties Image Occurences in reactions MNX_ID MNXM23184 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C119H207N5O60 charge 0 mass 2666.33003 reference lipidmapsM:LMSP0601FZ07 InChIKey NLAVBUPJFABJNL-NSEUACCKSA-N InChI InChI=1S/C119H207N5O60/c1-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-31-33-35-37-39-41-43-74(141)124-61(62(138)42-40-38-36-34-32-30-21-19-17-15-13-11-9-2)54-163-111-94(157)91(154)101(72(53-133)173-111)177-114-95(158)103(82(145)66(47-127)167-114)179-109-77(122-59(6)136)87(150)98(70(51-131)171-109)175-115-96(159)104(180-110-78(123-60(7)137)88(151)99(71(52-132)172-110)176-116-97(160)105(83(146)67(48-128)168-116)184-119(118(161)162)44-63(139)75(120-57(4)134)102(183-119)80(143)64(140)45-125)85(148)73(174-115)55-164-108-76(121-58(5)135)86(149)100(69(50-130)170-108)178-117-107(182-112-92(155)89(152)79(142)56(3)165-112)106(84(147)68(49-129)169-117)181-113-93(156)90(153)81(144)65(46-126)166-113/h22-23,40,42,56,61-73,75-117,125-133,138-140,142-160H,8-21,24-39,41,43-55H2,1-7H3,(H,120,134)(H,121,135)(H,122,136)(H,123,137)(H,124,141)(H,161,162)/b23-22-,42-40+/t56?,61-,62+,63?,64+,65?,66?,67?,68?,69?,70?,71?,72?,73?,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-,119-/m0/s1 SMILES CCCCCCCC/C=C\CCCCCCCCCCCCCC(=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)C7O)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