Cluster scaffolds:

NH2 O * O NH

2

NH2 O NH O OH

3

H2N

1

Putative metabolites:


Name Rank Metabolite Score Similarity MCS Score Post-Mod Score Post-Mod Info Source Link Smiles Molview Full Name Figure
Xenortide C 0 0.64 0.72 0.73 0.0 Glyco:0/2 * NO2:0/1 MIBiG Source CN[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1)C(C)C view Xenortide C NH O N O NH
Xenortide A 1 0.63 0.72 0.72 0.0 Glyco:0/2 * NO2:0/1 MIBiG Source CN[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1 view Xenortide A NH O N O NH
Xenortide D 2 0.56 0.6 0.67 0.0 Glyco:0/2 * NO2:0/1 MIBiG Source CN[C@H](C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1c[nH]c2ccccc12)C(C)C view Xenortide D NH O N O NH NH
Rhabdopeptide 1 3 0.55 0.56 0.69 0.0 Glyco:0/2 * NO2:0/1 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 NH O N O NH O N O NH
Xenortide B 4 0.55 0.6 0.66 0.0 Glyco:0/2 * NO2:0/1 MIBiG Source CN[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1c[nH]c2ccccc12 view Xenortide B NH O N O NH NH