Galalpha1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z))

Properties Image Occurences in reactions MNX_ID MNXM29900 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C104H184N4O48 charge 0 mass 2257.208 reference lipidmapsM:LMSP0505BV08 InChIKey BKNIBDZNMZXZAH-APLCGSDTSA-N InChI InChI=1S/C104H184N4O48/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-28-29-31-33-35-37-39-41-43-68(122)108-57(58(121)42-40-38-36-34-32-30-19-17-15-13-11-9-7-2)53-139-99-83(134)81(132)91(67(52-117)148-99)152-104-86(137)94(75(126)62(47-112)144-104)155-98-70(106-55(4)119)78(129)89(65(50-115)146-98)150-102-84(135)92(73(124)60(45-110)142-102)153-96-69(105-54(3)118)77(128)88(64(49-114)145-96)149-101-85(136)93(74(125)61(46-111)141-101)154-97-71(107-56(5)120)79(130)90(66(51-116)147-97)151-103-87(138)95(76(127)63(48-113)143-103)156-100-82(133)80(131)72(123)59(44-109)140-100/h20-21,40,42,57-67,69-104,109-117,121,123-138H,6-19,22-39,41,43-53H2,1-5H3,(H,105,118)(H,106,119)(H,107,120)(H,108,122)/b21-20-,42-40+/t57-,58+,59?,60?,61?,62?,63?,64?,65?,66?,67?,69?,70?,71?,72-,73-,74-,75-,76-,77+,78+,79+,80-,81+,82?,83?,84?,85?,86?,87?,88+,89+,90+,91+,92-,93-,94-,95-,96-,97-,98-,99+,100+,101-,102-,103-,104-/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](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]6OC(CO)[C@H](O)[C@H](O[C@@H]7OC(CO)[C@@H](O[C@@H]8OC(CO)[C@H](O)[C@H](O[C@H]9OC(CO)[C@H](O)[C@H](O)C9O)C8O)[C@H](O)C7NC(C)=O)C6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph