Petunidin 3,7-di-(6-malonylglucoside)

Properties Image Occurences in reactions MNX_ID MNXM27205 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C34H37O23 charge 1 mass 813.17201 reference lipidmapsM:LMPK12010367 InChIKey KFNIYQMLDQZODP-IBMDIIAYSA-O InChI InChI=1S/C34H36O23/c1-50-17-3-11(2-15(36)25(17)43)32-18(55-34-31(49)29(47)27(45)20(57-34)10-52-24(42)8-22(39)40)6-13-14(35)4-12(5-16(13)54-32)53-33-30(48)28(46)26(44)19(56-33)9-51-23(41)7-21(37)38/h2-6,19-20,26-31,33-34,44-49H,7-10H2,1H3,(H4-,35,36,37,38,39,40,43)/p+1/t19?,20?,26-,27-,28+,29+,30?,31?,33-,34-/m1/s1 SMILES COc1cc(-c2[o+]c3cc(O[C@@H]4OC(COC(=O)CC(=O)O)[C@@H](O)[C@H](O)C4O)cc(O)c3cc2O[C@@H]2OC(COC(=O)CC(=O)O)[C@@H](O)[C@H](O)C2O)cc(O)c1O

Parent-child relations graph

Deprecated MNXref IDs graph