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 | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Cyclochlorotine B | 0 | 0.62 | 0.51 | 0.6 | 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 | ||
| Deoxy-Cyclochlorotine | 1 | 0.58 | 0.52 | 0.6 | 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 | ||
| cyclochlorotine | 2 | 0.57 | 0.51 | 0.6 | 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](CO)NC(=O)C[C@H](c2ccccc2)NC(=O)[C@H](CO)NC1=O | view | cyclochlorotine | ||
| AM-toxin | 3 | 0.51 | 0.54 | 0.61 | 0.0 | Cl:0/1 | MIBiG | Source | C=C1NC(=O)C(CCc2ccc(OC)cc2)NC(=O)C(C(C)C)OC(=O)C(C)NC1=O | view | AM-toxin | ||
| Cyclotine | 4 | 0.5 | 0.52 | 0.61 | 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 |