Table 1 Numbers of spectral nodes for each superclass-level annotation provided by the MolNetEnhancer workflow.
ClassyFire Superclass | Positive ion mode | Negative ion mode |
|---|---|---|
Phenylpropanoids and polyketides | 1274 (7.71%) | 799 (12.16%) |
Benzenoids | 106 (0.64%) | 44 (0.67%) |
Organoheterocyclic compounds | 266 (1.61%) | 12 (0.18%) |
Organic nitrogen compounds | 6 (0.04%) | 0 (0.00%) |
Lignans, neolignans, and related compounds | 221 (1.34%) | 29 (0.44%) |
Organic oxygen compounds | 59 (0.36%) | 67 (1.02%) |
Lipids and lipid-like molecules | 765 (4.63%) | 602 (9.16%) |
Alkaloids and derivatives | 284 (1.72%) | 0 (0.00%) |
Organic acids and derivatives | 64 (0.39%) | 12 (0.18%) |
No matches | 13488 (81.58%) | 5005 (76.18%) |
Sum | 16533 | 6570 |
