Cluster scaffolds:
1 |
Putative metabolites:
| Name | Rank | Metabolite Score | Similarity | MCS Score | Post-Mod Score | Post-Mod Info | Source | Link | Smiles | Molview | Full Name | Figure | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| ectoine | 0 | 0.68 | 0.4 | 0.82 | 1.0 | Non detected. | MIBiG | Source | CC1=NCC[C@@H](C(=O)O)N1 | view | ectoine | ||
| itaconic acid | 1 | 0.66 | 0.52 | 0.68 | 1.0 | Non detected. | MIBiG | Source | C=C(CC(=O)O)C(=O)O | view | itaconic acid | ||
| 2-amino-4-methoxy-trans-3-butenoic acid | 2 | 0.65 | 0.49 | 0.68 | 1.0 | Non detected. | MIBiG | Source | CO/C=C/[C@H](N)C(=O)O | view | 2-amino-4-methoxy-trans-3-butenoic acid | ||
| citrulline | 3 | 0.62 | 0.44 | 0.66 | 1.0 | Non detected. | MIBiG | Source | NC(=O)NCCC[C@H](N)C(=O)O | view | citrulline | ||
| Alanylclavam | 4 | 0.57 | 0.38 | 0.61 | 1.0 | Non detected. | MIBiG | Source | N[C@@H](C[C@H]1CN2C(=O)C[C@@H]2O1)C(=O)O | view | Alanylclavam |