1 |
Name | Rank | Metabolite Score | Similarity | MCS Score | Post-Mod Score | Post-Mod Info | Source | Link | Smiles | Molview | Full Name | Figure | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
pacidamycin D | 4 | 0.6 | 0.63 | 0.47 | 1.0 | Non detected. | MIBiG | Source | C[C@H](N)C(=O)N(C)[C@@H](C)[C@H](NC(=O)[C@H](C)NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N/C=C1/C[C@@H](O)[C@H](n2ccc(=O)[nH]c2=O)O1 | view | pacidamycin D | ||
Sevadicin | 0 | 0.78 | 0.7 | 0.79 | 1.0 | Non detected. | MIBiG | Source | CC(NC(=O)C(N)Cc1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O | view | Sevadicin | ||
terezine D | 1 | 0.71 | 0.62 | 0.71 | 1.0 | Non detected. | MIBiG | Source | CC(C)=CCc1cccc2c(C[C@@H]3NC(=O)[C@H](C)NC3=O)c[nH]c12 | view | terezine D | ||
Xenocyloin C | 2 | 0.62 | 0.59 | 0.54 | 1.0 | Non detected. | MIBiG | Source | CC(=O)O[C@@H](Cc1c[nH]c2ccccc12)C(=O)C(C)C | view | Xenocyloin C | ||
Xenocyloin D | 3 | 0.61 | 0.59 | 0.52 | 1.0 | Non detected. | MIBiG | Source | CCC(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)OC(C)=O | view | Xenocyloin D |
© 2018 Pharmaceutical Bioinformatics