Fucalpha1-2Galbeta1-3GalNAcbeta1-4(NeuGcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z))

Properties Image Occurences in reactions MNX_ID MNXM28184 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C85H151N3O36 charge 0 mass 1790.00773 reference lipidmapsM:LMSP0601CN07 InChIKey GRYZBAWREMRMFB-UQICLWGNSA-N InChI InChI=1S/C85H151N3O36/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-59(99)87-51(52(96)39-37-35-33-31-29-27-18-16-14-12-10-8-6-2)48-113-80-71(109)69(107)73(57(45-92)117-80)119-82-72(110)77(124-85(84(111)112)41-53(97)61(88-60(100)47-94)76(123-85)64(102)54(98)42-89)74(58(46-93)118-82)120-79-62(86-50(4)95)75(66(104)56(44-91)115-79)121-83-78(68(106)65(103)55(43-90)116-83)122-81-70(108)67(105)63(101)49(3)114-81/h19-20,37,39,49,51-58,61-83,89-94,96-98,101-110H,5-18,21-36,38,40-48H2,1-4H3,(H,86,95)(H,87,99)(H,88,100)(H,111,112)/b20-19-,39-37+/t49?,51-,52+,53?,54+,55?,56?,57?,58?,61+,62?,63+,64+,65-,66-,67?,68-,69+,70-,71?,72?,73+,74-,75+,76?,77+,78?,79-,80+,81+,82-,83-,85-/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]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4O[C@H]4OC(C)[C@@H](O)C(O)[C@@H]4O)C3NC(C)=O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(=O)CO)C([C@H](O)[C@H](O)CO)O3)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph