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
Xenortide A
0
0.74
0.64
0.76
1.0
Non detected.
MIBiG
Source
CN[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1
view
Xenortide A
Ambactin
1
0.72
0.61
0.74
1.0
Non detected.
MIBiG
Source
CC(C)C[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2ccccc2)NC1=O
view
Ambactin
Xenortide C
2
0.72
0.64
0.72
1.0
Non detected.
MIBiG
Source
CN[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1)C(C)C
view
Xenortide C
Sevadicin
3
0.7
0.56
0.72
1.0
Non detected.
MIBiG
Source
CC(NC(=O)C(N)Cc1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
view
Sevadicin
marinacarboline...
4
0.68
0.45
0.78
1.0
Non detected.
MIBiG
Source
CC(=O)c1nc(C(=O)NCCc2ccccc2)cc2c1[nH]c1ccccc12
view
marinacarboline c
Xenortide B
5
0.68
0.52
0.71
1.0
Non detected.
MIBiG
Source
CN[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1c[nH]c2ccccc12
view
Xenortide B
virginiamycin
6
0.65
0.45
0.71
1.0
Non detected.
MIBiG
Source
CCC1NC(=O)C(NC(=O)c2ncccc2O)C(C)OC(=O)C(c2ccccc2)NC(=O)C2CC(=O)CCN2C(=O)C(Cc2ccccc2)N(C)C(=O)C2CCCN2C1=O
view
virginiamycin
Xenortide D
7
0.65
0.52
0.66
1.0
Non detected.
MIBiG
Source
CN[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1c[nH]c2ccccc12)C(C)C
view
Xenortide D
anabaenopeptin
8
0.65
0.54
0.65
1.0
Non detected.
MIBiG
Source
CC(C)[C@@H]1NC(=O)[C@H](NC(=O)N[C@@H](CCCN=C(N)N)C(=O)O)CCCCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](CCc2ccc(O)cc2)N(C)C1=O
view
anabaenopeptin
Rhabdopeptide 1
9
0.64
0.47
0.68
1.0
Non detected.
MIBiG
Source
CN[C@@H](CC(C)C)C(=O)N(C)[C@H](C(=O)N[C@H](C(=O)N(C)[C@H](C(=O)NCCc1ccccc1)C(C)C)C(C)C)C(C)C
view
Rhabdopeptide 1
Showing 1 to 10 of 50 entries
| Name | Rank | Metabolite Score | Similarity | MCS Score | Post-Mod Score | Post-Mod Info | Source | Link | Smiles | Molview | Full Name | Figure | |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Xenortide A | 0 | 0.74 | 0.64 | 0.76 | 1.0 | Non detected. | MIBiG | Source | CN[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1 | view | Xenortide A | ||
| Ambactin | 1 | 0.72 | 0.61 | 0.74 | 1.0 | Non detected. | MIBiG | Source | CC(C)C[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2ccccc2)NC1=O | view | Ambactin | ||
| Xenortide C | 2 | 0.72 | 0.64 | 0.72 | 1.0 | Non detected. | MIBiG | Source | CN[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1)C(C)C | view | Xenortide C | ||
| Sevadicin | 3 | 0.7 | 0.56 | 0.72 | 1.0 | Non detected. | MIBiG | Source | CC(NC(=O)C(N)Cc1ccccc1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O | view | Sevadicin | ||
| marinacarboline... | 4 | 0.68 | 0.45 | 0.78 | 1.0 | Non detected. | MIBiG | Source | CC(=O)c1nc(C(=O)NCCc2ccccc2)cc2c1[nH]c1ccccc12 | view | marinacarboline c | ||
| Xenortide B | 5 | 0.68 | 0.52 | 0.71 | 1.0 | Non detected. | MIBiG | Source | CN[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1c[nH]c2ccccc12 | view | Xenortide B | ||
| virginiamycin | 6 | 0.65 | 0.45 | 0.71 | 1.0 | Non detected. | MIBiG | Source | CCC1NC(=O)C(NC(=O)c2ncccc2O)C(C)OC(=O)C(c2ccccc2)NC(=O)C2CC(=O)CCN2C(=O)C(Cc2ccccc2)N(C)C(=O)C2CCCN2C1=O | view | virginiamycin | ||
| Xenortide D | 7 | 0.65 | 0.52 | 0.66 | 1.0 | Non detected. | MIBiG | Source | CN[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1c[nH]c2ccccc12)C(C)C | view | Xenortide D | ||
| anabaenopeptin | 8 | 0.65 | 0.54 | 0.65 | 1.0 | Non detected. | MIBiG | Source | CC(C)[C@@H]1NC(=O)[C@H](NC(=O)N[C@@H](CCCN=C(N)N)C(=O)O)CCCCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](CCc2ccc(O)cc2)N(C)C1=O | view | anabaenopeptin | ||
| Rhabdopeptide 1 | 9 | 0.64 | 0.47 | 0.68 | 1.0 | Non detected. | MIBiG | Source | CN[C@@H](CC(C)C)C(=O)N(C)[C@H](C(=O)N[C@H](C(=O)N(C)[C@H](C(=O)NCCc1ccccc1)C(C)C)C(C)C)C(C)C | view | Rhabdopeptide 1 |
Showing 1 to 10 of 50 entries