Ganglioside GA2 (d18:1(4E)/iso15:0)

Properties Image Occurences in reactions MNX_ID MNXM522121 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C53H98N2O18 charge 0 mass 1050.68146 reference slm:000487832 InChIKey IMQCUIJOSQHFHL-PLUQKSJQSA-N InChI InChI=1S/C53H98N2O18/c1-5-6-7-8-9-10-11-12-13-16-19-22-25-28-37(60)36(55-41(61)29-26-23-20-17-14-15-18-21-24-27-34(2)3)33-68-52-47(66)45(64)50(39(31-57)70-52)73-53-48(67)46(65)49(40(32-58)71-53)72-51-42(54-35(4)59)44(63)43(62)38(30-56)69-51/h25,28,34,36-40,42-53,56-58,60,62-67H,5-24,26-27,29-33H2,1-4H3,(H,54,59)(H,55,61)/b28-25+/t36-,37+,38+,39+,40+,42+,43-,44+,45+,46+,47+,48+,49-,50+,51-,52+,53-/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]3NC(C)=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCC(C)C

Parent-child relations graph

Deprecated MNXref IDs graph