GlcNAcbeta1-3Galbeta1-4(Fucalpha1-3)GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM24648 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C96H172N4O42 charge 0 mass 2053.14462 reference lipidmapsM:LMSP0505BH05 InChIKey SANLEBWYRNYHGO-JTOJYNIESA-N InChI InChI=1S/C96H172N4O42/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-64(112)100-55(56(111)41-39-37-35-33-31-29-20-18-16-14-12-10-8-2)50-127-92-78(123)76(121)83(62(48-106)135-92)137-95-79(124)86(70(115)58(44-102)131-95)141-90-66(98-53(5)109)74(119)82(61(47-105)133-90)136-94-80(125)88(72(117)59(45-103)130-94)142-91-67(99-54(6)110)85(139-93-77(122)75(120)68(113)51(3)128-93)84(63(49-107)134-91)138-96-81(126)87(71(116)60(46-104)132-96)140-89-65(97-52(4)108)73(118)69(114)57(43-101)129-89/h39,41,51,55-63,65-96,101-107,111,113-126H,7-38,40,42-50H2,1-6H3,(H,97,108)(H,98,109)(H,99,110)(H,100,112)/b41-39+/t51?,55-,56+,57?,58?,59?,60?,61?,62?,63?,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-,90-,91-,92+,93+,94-,95-,96-/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@H](O)[C@H](O[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)C7NC(C)=O)C6O)[C@H](O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph