GalNAcbeta1-3Galalpha1-3(GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM28193 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C76H139N3O28 charge 0 mass 1541.95451 reference lipidmapsM:LMSP0506AO05 InChIKey YKXTVQRWLUWQHE-PQBYMUSVSA-N InChI InChI=1S/C76H139N3O28/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-56(87)79-49(50(86)39-37-35-33-31-29-27-18-16-14-12-10-8-6-2)45-98-74-66(95)65(94)69(54(44-83)103-74)105-76-68(97)71(62(91)55(104-76)46-99-72-57(77-47(3)84)63(92)59(88)51(41-80)100-72)107-75-67(96)70(61(90)53(43-82)102-75)106-73-58(78-48(4)85)64(93)60(89)52(42-81)101-73/h37,39,49-55,57-76,80-83,86,88-97H,5-36,38,40-46H2,1-4H3,(H,77,84)(H,78,85)(H,79,87)/b39-37+/t49-,50+,51?,52?,53?,54?,55?,57?,58?,59+,60-,61-,62-,63+,64+,65+,66?,67?,68?,69+,70-,71-,72+,73-,74+,75+,76-/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]3OC(CO)[C@@H](O)[C@H](O)C3NC(C)=O)[C@H](O)[C@H](O[C@H]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4NC(C)=O)C3O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph