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 | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Clavam-2-carboxylate | 0 | 0.68 | 0.37 | 0.83 | 1.0 | Non detected. | MIBiG | Source | O=C(O)[C@H]1CN2C(=O)C[C@@H]2O1 | view | Clavam-2-carboxylate | ||
| citrulline | 1 | 0.61 | 0.47 | 0.61 | 1.0 | Non detected. | MIBiG | Source | NC(=O)NCCC[C@H](N)C(=O)O | view | citrulline | ||
| itaconic acid | 2 | 0.58 | 0.55 | 0.5 | 1.0 | Non detected. | MIBiG | Source | C=C(CC(=O)O)C(=O)O | view | itaconic acid | ||
| biotin | 3 | 0.53 | 0.37 | 0.53 | 1.0 | Non detected. | MIBiG | Source | O=C(O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 | view | biotin | ||
| 2-amino-4-methoxy-trans-3-butenoic acid | 4 | 0.5 | 0.4 | 0.44 | 1.0 | Non detected. | MIBiG | Source | CO/C=C/[C@H](N)C(=O)O | view | 2-amino-4-methoxy-trans-3-butenoic acid |