NeuAcalpha2-6Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:0)

Properties Image Occurences in reactions MNX_ID MNXM23510 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C81H147N3O31 charge 0 mass 1658.00185 reference lipidmapsM:LMSP0601ED06 InChIKey GZXCRUHUVIBIPD-ATSOMWGQSA-N InChI InChI=1S/C81H147N3O31/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-60(94)84-52(53(91)41-39-37-35-33-31-29-18-16-14-12-10-8-6-2)48-106-77-70(102)68(100)73(58(47-88)110-77)113-79-71(103)75(65(97)56(45-86)108-79)114-76-62(83-51(4)90)66(98)72(57(46-87)109-76)112-78-69(101)67(99)64(96)59(111-78)49-107-81(80(104)105)43-54(92)61(82-50(3)89)74(115-81)63(95)55(93)44-85/h39,41,52-59,61-79,85-88,91-93,95-103H,5-38,40,42-49H2,1-4H3,(H,82,89)(H,83,90)(H,84,94)(H,104,105)/b41-39+/t52-,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-,81+/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@]5(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)[C@H](O)[C@H](O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph