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

Properties Image Occurences in reactions MNX_ID MNXM27676 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C82H149N3O33 charge 0 mass 1704.00733 reference lipidmapsM:LMSP0502BL05 InChIKey NWFSASWDZBRXAW-LFFXDWKZSA-N InChI InChI=1S/C82H149N3O33/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-58(95)85-50(51(94)39-37-35-33-31-29-27-18-16-14-12-10-8-6-2)47-107-79-69(104)66(101)72(55(44-89)111-79)114-81-70(105)67(102)73(56(45-90)112-81)115-82-71(106)76(118-77-59(83-48(3)92)64(99)61(96)52(41-86)108-77)74(57(46-91)113-82)116-78-60(84-49(4)93)75(63(98)54(43-88)109-78)117-80-68(103)65(100)62(97)53(42-87)110-80/h37,39,50-57,59-82,86-91,94,96-106H,5-36,38,40-47H2,1-4H3,(H,83,92)(H,84,93)(H,85,95)/b39-37+/t50-,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 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@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@H](O)[C@H](O)C5O)C4NC(C)=O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4NC(C)=O)C3O)[C@H](O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph