Ganglioside GT1c (d18:1(4E)/iso15:0)

Properties Image Occurences in reactions MNX_ID MNXM525391 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C92H156N5O47 charge -3 mass 2082.99871 reference slm:000487354 InChIKey KHBCUGGPVLHBLE-ZVJSESGZSA-K InChI InChI=1S/C92H159N5O47/c1-8-9-10-11-12-13-14-15-16-19-22-25-28-31-50(109)49(97-61(114)32-29-26-23-20-17-18-21-24-27-30-44(2)3)43-131-84-74(123)72(121)76(59(41-103)134-84)136-86-75(124)82(77(60(42-104)135-86)137-83-65(96-48(7)108)78(68(117)56(38-100)132-83)138-85-73(122)71(120)67(116)55(37-99)133-85)144-92(89(129)130)35-53(112)64(95-47(6)107)81(143-92)70(119)58(40-102)140-91(88(127)128)34-52(111)63(94-46(5)106)80(142-91)69(118)57(39-101)139-90(87(125)126)33-51(110)62(93-45(4)105)79(141-90)66(115)54(113)36-98/h28,31,44,49-60,62-86,98-104,109-113,115-124H,8-27,29-30,32-43H2,1-7H3,(H,93,105)(H,94,106)(H,95,107)(H,96,108)(H,97,114)(H,125,126)(H,127,128)(H,129,130)/p-3/b31-28+/t49-,50+,51-,52-,53-,54+,55+,56+,57+,58+,59+,60+,62+,63+,64+,65+,66+,67-,68-,69+,70+,71-,72+,73+,74+,75+,76+,77-,78+,79+,80+,81+,82+,83-,84+,85-,86-,90+,91+,92-/m0/s1 SMILES CCCCCCCCCCCCC/C=C/[C@@H](O)[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@H]4O)[C@H]3NC(C)=O)[C@H](O[C@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@@H](CO)O[C@]4(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@@H](CO)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)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCC(C)C

Parent-child relations graph

Deprecated MNXref IDs graph