GD1aa(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM22730 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C90H160N4O39 charge 0 mass 1921.06597 reference lipidmapsM:LMSP0601BE05 InChIKey XTAMWCFFRPMCGA-LYFUZOKESA-N InChI InChI=1S/C90H160N4O39/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-64(108)94-54(55(103)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2)49-122-84-75(116)73(114)77(61(47-98)125-84)128-86-76(117)82(133-90(88(120)121)43-57(105)66(92-52(4)101)81(132-90)69(110)59(107)45-96)78(62(48-99)126-86)129-83-67(93-53(5)102)79(130-85-74(115)72(113)70(111)60(46-97)124-85)71(112)63(127-83)50-123-89(87(118)119)42-56(104)65(91-51(3)100)80(131-89)68(109)58(106)44-95/h38,40,54-63,65-86,95-99,103-107,109-117H,6-37,39,41-50H2,1-5H3,(H,91,100)(H,92,101)(H,93,102)(H,94,108)(H,118,119)(H,120,121)/b40-38+/t54-,55+,56?,57?,58+,59+,60?,61?,62?,63?,65+,66+,67?,68+,69+,70-,71-,72-,73+,74?,75?,76?,77+,78-,79+,80?,81?,82+,83-,84+,85-,86-,89+,90-/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@]4(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O4)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4O)C3NC(C)=O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O3)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph