Cluster | Block | Type | DB screening | Cluster browser | Domains | Modify scaffold | Specificity | Smiles | Postsynthetic modifications | Figure | |
---|---|---|---|---|---|---|---|---|---|---|---|
26 | 1 | nrps | Show | Open | Show | Scaffold Input | D * dhb * pip * D * D * G * D * G * dab * V * P * A * P | C(=O)N[C@H](C)C(=O)N[C@H](C1CCCN1)C(=O)N[C@H](CC(=O)O)C(=O)Oc1c(O)c(ccc1)C(=O)N1[C@@H](CCC1)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCN)C(=O)N[C@H](C(C)C)C(=O)N[C@H](C1CCCN1)C(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
2 | 1 | nrps-pks | Show | Open | Show | Scaffold Input | F * malonyl * methylmalonyl * methylmalonyl * methylmalonyl * methylmalonyl * malonyl * T * F * hpg * V * S | N[C@H](Cc1ccccc1)C(=O)CC=C(C)C(O)C(C)CC(C)CC(C)C(O)CC(=O)N[C@H](C(O)C)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](CNc1ccc(O)cc1)C(=O)N[C@H](C(C)C)C(=O)N[C@H](CO)C(=O)O | Glyco:0 * NO2:0 * Cl:2 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
1 | 1 | pks | Show | Open | Show | Scaffold Input | methylmalonyl * methylmalonyl * methylmalonyl * methylmalonyl * malonyl * methylmalonyl * malonyl * malonyl * methylmalonyl * malonyl * methylmalonyl * methylmalonyl | C(C)C=C(C)C=C(C)C=C(C)C=CC=C(C)C=CC=CC=C(C)C(O)CCC(C)C=C(C) | Glyco:2 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
39 | 1 | pks | Show | Open | Show | Scaffold Input | malonyl * methylmalonyl * malonyl * malonyl * malonyl * methylmalonyl * malonyl * methylmalonyl * malonyl * malonyl | CC=CC(O)C(C)C(=O)CC=C(C)C=CC(O)CCCC=C(C)C(=O)CC(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
37 | 1 | pks | Show | Open | Show | Scaffold Input | methylmalonyl * malonyl * malonyl * ethylmalonyl * malonyl * methylmalonyl * methylmalonyl * malonyl | C(O)C(C)C(=O)CC(O)CCC(CC)C=CCC(C)C(=O)C(C)C=C | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
32 | 1 | pks-nrps | Show | Open | Show | Scaffold Input | unknown * F * F | N[C@H](Cc1ccccc1)C(=O)C(*)C(=O)N[C@H](Cc1ccccc1) | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
27 | 1 | nrps | Show | Open | Show | Scaffold Input | F * orn * horn | C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](CCCN)C(=O)N[C@H](CCCNO)C(=O)O | None | ||
| |||||||||||
36 | 1 | nrps | Show | Open | Show | Scaffold Input | dhb * C * C | Oc1c(O)c(ccc1)C(=O)N[C@H](CS)C(=O)N[C@H](CS)C(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
9 | 2 | nrps-pks | Show | Open | Show | Scaffold Input | V * P * unknown | N[C@H](C(C)C)C(=O)N[C@H](C1CCCN1)C(O)C(*)C(=O)O | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
| |||||||||||
38 | 1 | nrps | Show | Open | Show | Scaffold Input | S * T * horn | N[C@@H](CO)C(=O)N[C@@H](C(O)C)C(=O)N[C@H](CCCNO) | Glyco:0 * NO2:0 * Cl:0 * SS:0 * 6-Ring:0 * Sphingo:0 * 5-Ring:0 | ||
|
© 2018 Pharmaceutical Bioinformatics