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 | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| ochratoxin A | 0 | 0.44 | 0.56 | 0.46 | 0.0 | Glyco:0/3 | MIBiG | Source | C[C@@H]1Cc2c(Cl)cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1 | view | ochratoxin A | ||
| nocardicin A | 1 | 0.42 | 0.53 | 0.45 | 0.0 | Glyco:0/3 | MIBiG | Source | N[C@H](CCOc1ccc(/C(=N\O)C(=O)N[C@H]2CN([C@@H](C(=O)O)c3ccc(O)cc3)C2=O)cc1)C(=O)O | view | nocardicin A | ||
| Xenortide C | 2 | 0.41 | 0.55 | 0.4 | 0.0 | Glyco:0/3 | MIBiG | Source | CN[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1)C(C)C | view | Xenortide C | ||
| Xenortide A | 3 | 0.41 | 0.55 | 0.4 | 0.0 | Glyco:0/3 | MIBiG | Source | CN[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1 | view | Xenortide A | ||
| Sevadicin | 4 | 0.39 | 0.54 | 0.37 | 0.0 | Glyco:0/3 | MIBiG | Source | CC(NC(=O)C(N)Cc1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O | view | Sevadicin |