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 | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| barbamide | 0 | 0.53 | 0.52 | 0.47 | 0.8 | Cl:3/2 | MIBiG | Source | CO/C(=C/C(=O)N(C)C(Cc1ccccc1)c1nccs1)CC(C)C(Cl)(Cl)Cl | view | barbamide | ||
| Xenortide C | 1 | 0.46 | 0.54 | 0.51 | 0.0 | Cl:0/2 | MIBiG | Source | CN[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1)C(C)C | view | Xenortide C | ||
| haliamide | 2 | 0.45 | 0.52 | 0.51 | 0.0 | Cl:0/2 | MIBiG | Source | C=CC(C)C/C(C)=C/C=C/C(C)NC(=O)c1ccccc1 | view | haliamide | ||
| Xenortide A | 3 | 0.45 | 0.54 | 0.5 | 0.0 | Cl:0/2 | MIBiG | Source | CN[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1 | view | Xenortide A | ||
| Benzylpenicillin | 4 | 0.44 | 0.57 | 0.45 | 0.0 | Cl:0/2 | MIBiG | Source | CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)[O-].[Na+] | view | Benzylpenicillin |