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

Properties Image Occurences in reactions MNX_ID MNXM25794 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C88H157N3O36 charge 0 mass 1832.05468 reference lipidmapsM:LMSP0504AS07 InChIKey JJWNIUYJAVBVNL-LRJSDPPASA-N InChI InChI=1S/C88H157N3O36/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-60(100)91-53(54(99)41-39-37-35-33-31-29-20-18-16-14-12-10-8-2)48-114-84-73(111)70(108)76(58(46-95)121-84)122-87-74(112)80(66(104)56(44-93)118-87)127-83-62(90-52(6)98)79(77(59(47-96)120-83)123-85-71(109)68(106)63(101)49(3)115-85)125-88-75(113)81(67(105)57(45-94)119-88)126-82-61(89-51(5)97)78(65(103)55(43-92)117-82)124-86-72(110)69(107)64(102)50(4)116-86/h21-22,39,41,49-50,53-59,61-88,92-96,99,101-113H,7-20,23-38,40,42-48H2,1-6H3,(H,89,97)(H,90,98)(H,91,100)/b22-21-,41-39+/t49?,50?,53-,54+,55?,56?,57?,58?,59?,61?,62?,63+,64+,65+,66-,67-,68?,69?,70+,71-,72-,73?,74?,75?,76+,77+,78+,79+,80-,81-,82-,83-,84+,85+,86+,87-,88-/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(C)[C@@H](O)C(O)[C@@H]4O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O)[C@H](O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)C5NC(C)=O)C4O)C3NC(C)=O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph