disialyl Lea(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM27193 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C92H162N4O43 charge 0 mass 2011.06128 reference lipidmapsM:LMSP0601EA03 InChIKey CBAWEISDLIDDDE-AHLFTTHCSA-N InChI InChI=1S/C92H162N4O43/c1-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-62(110)96-52(53(105)37-35-33-31-29-27-25-20-18-16-14-12-10-8-2)46-126-85-74(119)72(117)77(60(45-101)131-85)133-87-75(120)82(69(114)58(43-99)129-87)136-84-65(95-51(6)104)81(135-88-76(121)83(70(115)59(44-100)130-88)139-92(90(124)125)40-55(107)64(94-50(5)103)80(138-92)68(113)57(109)42-98)78(134-86-73(118)71(116)66(111)48(3)128-86)61(132-84)47-127-91(89(122)123)39-54(106)63(93-49(4)102)79(137-91)67(112)56(108)41-97/h35,37,48,52-61,63-88,97-101,105-109,111-121H,7-34,36,38-47H2,1-6H3,(H,93,102)(H,94,103)(H,95,104)(H,96,110)(H,122,123)(H,124,125)/b37-35+/t48?,52-,53+,54?,55?,56+,57+,58?,59?,60?,61?,63+,64+,65?,66+,67+,68+,69-,70-,71?,72+,73-,74?,75?,76?,77+,78+,79?,80?,81+,82-,83-,84-,85+,86+,87-,88-,91+,92-/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](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]4OC(C)[C@@H](O)C(O)[C@@H]4O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@]5(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)C4O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph