Fucalpha1-3GlcNAcbeta1-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/22:0)

Properties Image Occurences in reactions MNX_ID MNXM28565 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C91H162N4O40 charge 0 mass 1951.07654 reference lipidmapsM:LMSP0601BT04 InChIKey FDQFWQHFXDSFCU-CMCLTCLJSA-N InChI InChI=1S/C91H162N4O40/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-36-38-40-62(108)95-53(54(105)39-37-35-33-31-29-27-20-18-16-14-12-10-8-2)48-122-86-74(117)72(115)77(60(46-100)127-86)129-89-76(119)83(135-91(90(120)121)41-55(106)63(92-50(4)102)81(134-91)67(110)56(107)42-96)78(61(47-101)128-89)130-84-64(93-51(5)103)80(69(112)57(43-97)124-84)132-88-75(118)82(70(113)59(45-99)126-88)133-85-65(94-52(6)104)79(68(111)58(44-98)125-85)131-87-73(116)71(114)66(109)49(3)123-87/h37,39,49,53-61,63-89,96-101,105-107,109-119H,7-36,38,40-48H2,1-6H3,(H,92,102)(H,93,103)(H,94,104)(H,95,108)(H,120,121)/b39-37+/t49?,53-,54+,55?,56+,57?,58?,59?,60?,61?,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-,89-,91-/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]3OC(CO)[C@H](O)[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)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O3)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph