Ganglioside GM1b (d18:1(4E)/26:5(11Z,14Z,17Z,20Z,23Z))

Properties Image Occurences in reactions MNX_ID MNXM523580 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C81H136N3O31 charge -1 mass 1646.91633 reference slm:000486497 InChIKey DGTXHNAECOMBMW-PPKLYFIVSA-M InChI InChI=1S/C81H137N3O31/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-60(95)84-52(53(92)41-39-37-35-33-31-29-18-16-14-12-10-8-6-2)49-106-77-68(101)66(99)72(58(47-88)109-77)112-78-69(102)67(100)71(59(48-89)110-78)111-76-62(83-51(4)91)73(64(97)56(45-86)107-76)113-79-70(103)75(65(98)57(46-87)108-79)115-81(80(104)105)43-54(93)61(82-50(3)90)74(114-81)63(96)55(94)44-85/h7,9,13,15,19-20,22-23,25-26,39,41,52-59,61-79,85-89,92-94,96-103H,5-6,8,10-12,14,16-18,21,24,27-38,40,42-49H2,1-4H3,(H,82,90)(H,83,91)(H,84,95)(H,104,105)/p-1/b9-7-,15-13-,20-19-,23-22-,26-25-,41-39+/t52-,53+,54-,55+,56+,57+,58+,59+,61+,62+,63+,64-,65-,66+,67+,68+,69+,70+,71-,72+,73+,74+,75-,76-,77+,78-,79-,81-/m0/s1 SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H]3NC(C)=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph