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 | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| betaenone A | 0 | 0.55 | 0.49 | 0.74 | 0.0 | Glyco:0/3 | MIBiG | Source | CCC(C)C1C2(C)C(=O)/C(=C\O)C(O)(C3CC(C)(O)CC(C)C32)C1(C)O | view | betaenone A | ||
| chaxamycin B | 1 | 0.52 | 0.48 | 0.69 | 0.0 | Glyco:0/3 | MIBiG | Source | CC1=C2NC(=O)/C=C\C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](C)/C=C(/C)C(=O)c3c(O)c(C)cc(c3C1=O)C2=O | view | chaxamycin B | ||
| chaxamycin C | 2 | 0.52 | 0.48 | 0.68 | 0.0 | Glyco:0/3 | MIBiG | Source | CC1=C2NC(=O)/C=C\C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](CO)/C=C(/C)C(=O)c3c(O)c(C)c(O)c(c3C1=O)C2=O | view | chaxamycin C | ||
| chaxamycin A | 3 | 0.52 | 0.47 | 0.68 | 0.0 | Glyco:0/3 | MIBiG | Source | CC1=C2NC(=O)/C=C\C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](C)/C=C(/C)C(=O)c3c(O)c(C)c(O)c(c3C1=O)C2=O | view | chaxamycin A | ||
| botcinic acid | 4 | 0.51 | 0.52 | 0.63 | 0.0 | Glyco:0/3 | MIBiG | Source | CCCC[C@H](O)/C=C/C(=O)O[C@H]1[C@H](C)O[C@](C)([C@@H](O)[C@@H](C)C(=O)O)[C@@H](O)[C@@H]1C | view | botcinic acid |