Figure 7. A proposed network of the detected anthocyanin family featuring putatively novel compounds as well as known structures including the KEGG pathway of anthocyanin biosynthesis [38], [44].

Only compounds from the KEGG anthocyanin pathway are depicted, for which a suitable precursor mass was found in the data. Exact masses, sum formulas, and main MS² fragments of the new compounds are compiled in Table 1; reconstructed structures together with MS² scans are in the supporting information. The network was created with VANTED [45], [46].