GalNAcalpha1-3GalNAcbeta1-3Galalpha1-3(GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM27679 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C80H144N4O33 charge 0 mass 1688.97128 reference lipidmapsM:LMSP0506AL03 InChIKey KEAJFCHDJXUIDZ-QKSXZJRYSA-N InChI InChI=1S/C80H144N4O33/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-56(94)84-48(49(93)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2)43-106-78-68(103)67(102)71(54(42-89)112-78)114-80-70(105)74(64(99)55(113-80)44-107-75-57(81-45(3)90)65(100)60(95)50(38-85)108-75)117-79-69(104)73(63(98)53(41-88)111-79)116-77-59(83-47(5)92)72(62(97)52(40-87)110-77)115-76-58(82-46(4)91)66(101)61(96)51(39-86)109-76/h34,36,48-55,57-80,85-89,93,95-105H,6-33,35,37-44H2,1-5H3,(H,81,90)(H,82,91)(H,83,92)(H,84,94)/b36-34+/t48-,49+,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+,77-,78+,79+,80-/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[C@H]5OC(CO)[C@H](O)[C@H](O)C5NC(C)=O)C4NC(C)=O)C3O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph