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 | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Xenortide C | 2 | 0.57 | 0.61 | 0.69 | 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 | ||
| Xenortide A | 3 | 0.56 | 0.59 | 0.68 | 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 | 0.46 | 0.57 | 0.5 | 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 | ||
| haliamide | 0 | 0.62 | 0.58 | 0.81 | 0.0 | Cl:0/2 | MIBiG | Source | C=CC(C)C/C(C)=C/C=C/C(C)NC(=O)c1ccccc1 | view | haliamide | ||
| azaspirene | 1 | 0.57 | 0.56 | 0.73 | 0.0 | Cl:0/2 | MIBiG | Source | CC/C=C/C=C/C1=C(C)C(=O)C2(O1)C(=O)N[C@@](O)(Cc1ccccc1)[C@@H]2O | view | azaspirene |