Galbeta1-3(NeuAcalpha2-8NeuAcalpha2-6)GalNAcbeta1-4Galbeta1-4Glcbeta-Cer(d18:1/26:0)

Properties Image Occurences in reactions MNX_ID MNXM29697 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C92H164N4O39 charge 0 mass 1949.09727 reference lipidmapsM:LMSP0601GM06 InChIKey CKKNTSDYPHCUTE-RXESRTLMSA-N InChI InChI=1S/C92H164N4O39/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-28-29-31-33-35-37-39-41-43-66(109)96-56(57(105)42-40-38-36-34-32-30-19-17-15-13-11-9-7-2)51-124-86-78(118)75(115)81(63(49-100)127-86)131-88-79(119)76(116)80(64(50-101)128-88)130-85-69(95-55(5)104)82(132-87-77(117)74(114)71(111)61(47-98)126-87)73(113)65(129-85)52-125-91(89(120)121)44-58(106)68(94-54(4)103)84(134-91)72(112)62(48-99)133-92(90(122)123)45-59(107)67(93-53(3)102)83(135-92)70(110)60(108)46-97/h40,42,56-65,67-88,97-101,105-108,110-119H,6-39,41,43-52H2,1-5H3,(H,93,102)(H,94,103)(H,95,104)(H,96,109)(H,120,121)(H,122,123)/b42-40+/t56-,57+,58?,59?,60+,61?,62+,63?,64?,65?,67+,68+,69?,70+,71-,72+,73-,74-,75+,76+,77?,78?,79?,80-,81+,82+,83?,84?,85-,86+,87-,88-,91+,92+/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@]4(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@@H](CO)O[C@]5(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)O4)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4O)C3NC(C)=O)[C@H](O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph