Gentiocyanin C

Properties Image Occurences in reactions MNX_ID MNXM54892 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C36H37O18 charge 1 mass 757.19744 reference lipidmapsM:LMPK12010158 InChIKey NHTJKRAGLGHCLR-UZMBYUDCSA-O InChI InChI=1S/C36H36O18/c37-13-25-28(43)30(45)32(47)36(53-25)52-24-12-19-22(50-34(24)16-4-7-20(40)21(41)9-16)10-18(39)11-23(19)51-35-33(48)31(46)29(44)26(54-35)14-49-27(42)8-3-15-1-5-17(38)6-2-15/h1-12,25-26,28-33,35-37,43-48H,13-14H2,(H3-,38,39,40,41,42)/p+1/t25?,26?,28-,29-,30?,31+,32?,33?,35-,36-/m1/s1 SMILES O=C(/C=C/c1ccc(O)cc1)OCC1O[C@@H](Oc2cc(O)cc3[o+]c(-c4ccc(O)c(O)c4)c(O[C@@H]4OC(CO)[C@@H](O)C(O)C4O)cc23)C(O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph