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 | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| bacillaene | 3 | 0.46 | 0.54 | 0.52 | 0.0 | 6-Ring:0/1 | MIBiG | Source | C/C(=C/C=C/C=C/C(C)C(=O)O)NC(=O)CC(O)/C(C)=C\C=C/C=C(C)/C=C/C=C\CCCNC(=O)C(O)CC(C)C | view | bacillaene | ||
| thailandamide A | 2 | 0.48 | 0.53 | 0.56 | 0.0 | 6-Ring:0/1 | MIBiG | Source | CO[C@H](/C(C)=C/C=C/C=C(C)/C=C/C[C@H](O)CC(=O)/C=C/C=C(C)/C=C/[C@@H](C)NC(=O)[C@H](C)C/C=C/C[C@@H](O)Cc1ccc(O)cc1)[C@@H](C)C(=O)O | view | thailandamide A | ||
| thailandamide B | 1 | 0.48 | 0.53 | 0.56 | 0.0 | 6-Ring:0/1 | MIBiG | Source | CO[C@H](/C(C)=C/C=C/C=C(C)/C=C/C[C@H](O)CC(=O)/C=C\C=C(C)\C=C\[C@@H](C)NC(=O)[C@H](C)C/C=C/C[C@@H](O)Cc1ccc(O)cc1)[C@@H](C)C(=O)O | view | thailandamide B | ||
| astaxanthin | 0 | 0.51 | 0.52 | 0.63 | 0.0 | 6-Ring:0/1 | MIBiG | Source | CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C(=O)C(O)CC2(C)C)C(C)(C)CC(O)C1=O | view | astaxanthin | ||
| zeaxanthin | 4 | 0.44 | 0.52 | 0.48 | 0.0 | 6-Ring:0/1 | MIBiG | Source | CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O)CC2(C)C)C(C)(C)C[C@H](O)C1 | view | zeaxanthin |