Cluster | Block | Type | DB screening | Cluster browser | Domains | Modify scaffold | Specificity | Smiles | Postsynthetic modifications | Figure | |
---|---|---|---|---|---|---|---|---|---|---|---|
8 | 1 | pks-nrps | Show | Open | Show | Scaffold Input | methylmalonyl * malonyl * malonyl * malonyl * malonyl * methylmalonyl * methylmalonyl * malonyl * malonyl * methylmalonyl * malonyl * methylmalonyl * methylmalonyl * malonyl * methylmalonyl * malonyl * malonyl * methylmalonyl * methylmalonyl * malonyl * methylmalonyl * F | N[C@H](Cc1ccccc1)C(O)C(C)C(O)CC=CC(O)CC(O)CC=C(C)C(O)C(C)C(O)CC(O)CC(O)C(C)C(O)CC=C(C)C(O)C(C)C=CC(O)C(C)C=CCCC(O)C(C)C(O)C(C)CCC=C(C)C(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:1 * Sphingo:0 * 5-Ring:1 | ||
| |||||||||||
5 | 1 | pks-nrps | Show | Open | Show | Scaffold Input | methylmalonyl * methylmalonyl * malonyl * methylmalonyl * malonyl * malonyl * malonyl * malonyl * malonyl * malonyl * malonyl * methylmalonyl * malonyl * methylmalonyl * malonyl * methylmalonyl * malonyl * malonyl * malonyl * F | CCC(=O)N[C@H](Cc1ccccc1)C=C(C)C(O)C(C)C=CC=C(C)C(O)CC(O)CC(O)CC(O)CC(O)CC(O)CC(=O)CC(O)C(C)CCC(O)C(C)C(O)CC(O)C(C)C=CC=CC(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:1 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
37 | 1 | nrps | Show | Open | Show | Scaffold Input | L * A * V * L * L * orn * T * orn * V * L | N[C@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN)C(=O)N[C@H](C(O)C)C(=O)N[C@@H](CCCN)C(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC(C)C) | None | ||
| |||||||||||
4 | 1 | nrps | Show | Open | Show | Scaffold Input | D * T * S * dhb * T * T * S * F * G * F | N[C@H](Cc1ccccc1)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](C(O)C)C(=O)N[C@H](CO)C(=O)Oc1c(O)c(ccc1)C(=O)N[C@H](C(O)C)C(=O)N[C@H](C(O)C)C(=O)N[C@H](CO)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)CC(=O)O | None | ||
| |||||||||||
36 | 1 | nrps-pks | Show | Open | Show | Scaffold Input | F * F * A * T * F * F * unknown * W * dhb | Oc1c(O)c(ccc1)N[C@H](Cc1ccccc1)C(=O)C(*)C(=O)N[C@H](CC1=CNC(=C12)C=CC=C2)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C(=O)N[C@H](C(O)C)C(=O)N[C@H](Cc1ccccc1)C(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
8 | 2 | nrps-pks | Show | Open | Show | Scaffold Input | F * methylmalonyl * methylmalonyl * methylmalonyl * malonyl * methylmalonyl * malonyl | N[C@H](Cc1ccccc1)C=C(C)C=C(C)C=C(C)CCC(=O)C(C)C(=O)CC(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:1 * Sphingo:0 * 5-Ring:1 | ||
| |||||||||||
16 | 3 | nrps | Show | Open | Show | Scaffold Input | W * A * A * A * A * A | N[C@@H](CC1=CNC(=C12)C=CC=C2)C(=O)N[C@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
13 | 1 | nrps | Show | Open | Show | Scaffold Input | F * A * F * L * F * L | N[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)O | None | ||
| |||||||||||
2 | 1 | nrps | Show | Open | Show | Scaffold Input | V * A * A * V * A * V | N[C@@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](C)C(=O)N(C)[C@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(C)C)C(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
7 | 1 | nrps | Show | Open | Show | Scaffold Input | P * P * L * P * P | N[C@H](C1CCCN1)C(=O)N[C@H](C1CCCN1)C(=O)N[C@H](C1CCCN1)C(=O)N[C@H](C1CCCN1)C(=O)N[C@H](CC(C)C)C(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
|
© 2018 Pharmaceutical Bioinformatics