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 | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| itaconic acid | 0 | 0.58 | 0.53 | 0.76 | 0.0 | Cl:0/2 | MIBiG | Source | C=C(CC(=O)O)C(=O)O | view | itaconic acid | ||
| 2-amino-4-methoxy-trans-3-butenoic acid | 1 | 0.5 | 0.43 | 0.68 | 0.0 | Cl:0/2 | MIBiG | Source | CO/C=C/[C@H](N)C(=O)O | view | 2-amino-4-methoxy-trans-3-butenoic acid | ||
| ectoine | 2 | 0.46 | 0.38 | 0.64 | 0.0 | Cl:0/2 | MIBiG | Source | CC1=NCC[C@@H](C(=O)O)N1 | view | ectoine | ||
| Clavam-2-carboxylate | 3 | 0.44 | 0.35 | 0.62 | 0.0 | Cl:0/2 | MIBiG | Source | O=C(O)[C@H]1CN2C(=O)C[C@@H]2O1 | view | Clavam-2-carboxylate | ||
| methylenomycin | 4 | 0.44 | 0.38 | 0.59 | 0.0 | Cl:0/2 | MIBiG | Source | C=C1C(=O)C2(C)OC2(C)C1C(=O)O | view | methylenomycin |