NeuGcalpha2-3Galbeta1-4GlcNAcbeta1-3(GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z))

Properties Image Occurences in reactions MNX_ID MNXM26137 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C101H177N5O47 charge 0 mass 2212.16139 reference lipidmapsM:LMSP0601EP07 InChIKey QWZZOTCPLIXFBO-GOQDKRKFSA-N InChI InChI=1S/C101H177N5O47/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-67(121)105-56(57(118)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2)51-138-96-82(132)81(131)88(65(49-113)145-96)149-97-83(133)90(75(125)61(45-109)141-97)150-94-71(103-54(4)116)79(129)86(63(47-111)143-94)147-98-84(134)91(77(127)66(146-98)52-139-93-70(102-53(3)115)78(128)74(124)60(44-108)140-93)151-95-72(104-55(5)117)80(130)87(64(48-112)144-95)148-99-85(135)92(76(126)62(46-110)142-99)153-101(100(136)137)42-58(119)69(106-68(122)50-114)89(152-101)73(123)59(120)43-107/h20-21,38,40,56-66,69-99,107-114,118-120,123-135H,6-19,22-37,39,41-52H2,1-5H3,(H,102,115)(H,103,116)(H,104,117)(H,105,121)(H,106,122)(H,136,137)/b21-20-,40-38+/t56-,57+,58?,59+,60?,61?,62?,63?,64?,65?,66?,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-,101-/m0/s1 SMILES CCCCCCCC/C=C\CCCCCCCCCCCCCC(=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]5OC(CO)[C@@H](O)[C@H](O)C5NC(C)=O)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@]7(C(=O)O)CC(O)[C@@H](NC(=O)CO)C([C@H](O)[C@H](O)CO)O7)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