Table 1.
Peak number | Metabolite | Elemental formula | KEGG IDa | Metabolite codeb | Mass [M–H] (Da) | Rct (sec) | Log2 fold changed |
---|---|---|---|---|---|---|---|
2782 | Aspartate | C4H7NO4 | C00049 | 132.0302 | 749.1 | 1.577 | |
2873 | Glutamate | C5H9NO4 | C00025 | Rta | 146.0458 | 725.7 | 1.0159 |
2981 | Glutamine | C5H10N2O3 | C00064 | Rta | 145.0618 | 781.3 | n/a(e) |
3171 | Citrulline | C6H13N3O3 | C00327 | Rta | 174.0884 | 813.1 | 3.5413 |
3252 | N-Acetyl-l-glutamate | C7H11NO5 | C00624 | Rta | 188.0564 | 691.1 | 4.3654 |
3505 | l-Arginosuccinate | C10H18N4O6 | C03406 | 289.1156 | 800.5 | n/af | |
3608 | N-Acetyl-l-citrulline | C8H15N3O4 | C15532 | 216.099 | 594.1 | 5.049 | |
3636 | N-Acetyl-ornithine | C7H14N2O3 | C00437 | Rta | 173.0931 | 791.2 | 1.068 |
3838 | Arginine | C6H14N4O2 | C00062 | 173.1044 | 1304.1 | 1.3781 |
aSee reference Kanehisa and Goto 2000
bSee reference Sumner et al. 2014
cRetention time
dLog2 fold change in expression of metabolite between planktonic and biofilm data sets
eNot available, fold change unable to be formulated as peak intensities did not significantly change between sample sets
fNot available, fold change unable to be formulated as only detected in the planktonic data set and not in the biofilm data set