Cluster scaffolds:
1 |
2 |
Putative metabolites:
| Name | Rank | Metabolite Score | Similarity | MCS Score | Post-Mod Score | Post-Mod Info | Source | Link | Smiles | Molview | Full Name | Figure | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Xenocoumacin II | 4 | 0.5 | 0.54 | 0.6 | 0.0 | Cl:0/1 | MIBiG | Source | CC(C)CC(NC(=O)C(O)C(O)C1CCCN1)C1Cc2cccc(O)c2C(=O)O1 | view | Xenocoumacin II | ||
| Cyclochlorotine B | 0 | 0.68 | 0.54 | 0.71 | 1.0 | Cl:1/1 | MIBiG | Source | CC[C@@H]1NC(=O)[C@@H]2[C@H](Cl)CCN2C(=O)[C@H](CO)NC(=O)C[C@H](c2ccccc2)NC(=O)[C@H](CO)NC1=O | view | Cyclochlorotine B | ||
| Sevadicin | 1 | 0.64 | 0.57 | 0.85 | 0.0 | Cl:0/1 | MIBiG | Source | CC(NC(=O)C(N)Cc1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O | view | Sevadicin | ||
| Deoxy-Cyclochlorotine | 2 | 0.64 | 0.55 | 0.71 | 0.67 | Cl:2/1 | MIBiG | Source | CC[C@@H]1NC(=O)[C@@H]2[C@H](Cl)[C@H](Cl)CN2C(=O)[C@H](C)NC(=O)C[C@H](c2ccccc2)NC(=O)[C@H](CO)NC1=O | view | Deoxy-Cyclochlorotine | ||
| Cyclotine | 3 | 0.56 | 0.54 | 0.72 | 0.0 | Cl:0/1 | MIBiG | Source | CC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CO)NC(=O)C[C@H](c2ccccc2)NC(=O)[C@H](CO)NC1=O | view | Cyclotine |