Fucalpha2-3Galbeta1-3GalNAcbeta1-4Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z))

Properties Image Occurences in reactions MNX_ID MNXM23844 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C82H148N2O32 charge 0 mass 1673.00152 reference lipidmapsM:LMSP0502BM08 InChIKey XDBYTFSJOAUKDE-MHWUFYKLSA-N InChI InChI=1S/C82H148N2O32/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-58(92)84-51(52(91)41-39-37-35-33-31-29-18-16-14-12-10-8-6-2)48-105-79-67(100)64(97)72(55(45-87)109-79)114-81-69(102)66(99)73(57(47-89)111-81)115-80-68(101)65(98)71(56(46-88)110-80)113-78-59(83-50(4)90)74(61(94)53(43-85)107-78)116-82-70(103)75(62(95)54(44-86)108-82)112-76-63(96)60(93)49(3)106-77(76)104/h19-20,39,41,49,51-57,59-82,85-89,91,93-104H,5-18,21-38,40,42-48H2,1-4H3,(H,83,90)(H,84,92)/b20-19-,41-39+/t49?,51-,52+,53?,54?,55?,56?,57?,59?,60+,61-,62-,63?,64+,65+,66+,67?,68?,69?,70?,71-,72+,73-,74+,75-,76-,77+,78-,79+,80-,81-,82-/m0/s1 SMILES CCCCCCCC/C=C\CCCCCCCCCCCCCCCC(=O)N[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]4OC(CO)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@H](O)[C@H](O[C@H]6C(O)[C@H](O)C(C)O[C@H]6O)C5O)C4NC(C)=O)[C@H](O)C3O)[C@H](O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph