pentabromopseudilin
naturalproductmech:mibig-005498ea51 MINTED SEEDED enzyme inhibitor
Structure
| Standard InChIKey | LXMNWKJHYOZUQL-UHFFFAOYSA-N |
|---|---|
| SMILES | C1=C(C=C(C(=C1Br)O)C2=C(C(=C(N2)Br)Br)Br)Br |
| Stereochemistry | fully defined |
| Cross-references | pubchem:324093 |
Filing pathway
Shikimates and phenylpropanoids — computed by NPClassifier npclassifier.gnps2.org@2026-09-07, which is why it is pinned rather than recomputed. The gene cluster's asserted class is other, from MIBiG.
Producer organisms 3
A claim that this taxon makes the compound. The basis says what the evidence addressed — a knockout and a database assertion are not the same claim.
| Taxon | Basis | Cluster | Evidence |
|---|---|---|---|
| Pseudoalteromonas luteoviolacea 2ta16 NCBITaxon:1353533 |
BGC_CORRELATED | mibig:BGC0000891 | PMID:24974229 |
| Pseudoalteromonas phenolica O-BC30 NCBITaxon:1315281 |
SOURCE_ASSERTION | mibig:BGC0000890 | PMID:24974229 |
| Marinomonas mediterranea MMB-1 NCBITaxon:717774 |
SOURCE_ASSERTION | mibig:BGC0001465 | PMID:24974229 |
Occurrences 2
Somebody found the compound in this organism and cited it. That is not a claim that the organism makes it, and nothing here promotes one to the other.
| Taxon | Source | Reference |
|---|---|---|
| Pseudoalteromonas luteoviolacea NCBITaxon:43657 |
LOTUS | DOI:10.1021/JO00092A020 |
| Pseudoalteromonas luteoviolacea NCBITaxon:43657 |
LOTUS | DOI:10.1021/NP100506Z |
Biosynthetic gene clusters 3
| Accession | Host | Locus evidence | Genome |
|---|---|---|---|
| mibig:BGC0000891 | Pseudoalteromonas luteoviolacea 2ta16 NCBITaxon:1353533 |
CLUSTER_DEMONSTRATED | genbank:AUSV01000133.1 |
| mibig:BGC0000890 | Pseudoalteromonas phenolica O-BC30 NCBITaxon:1315281 |
CLUSTER_DEMONSTRATED | genbank:KF540211.1 |
| mibig:BGC0001465 | Marinomonas mediterranea MMB-1 NCBITaxon:717774 |
CLUSTER_UNSTATED | genbank:NC_015276.1 |
A locus claim and a taxon claim are different questions. Heterologous expression settles the first and leaves the second where the isolation report left it.
Bioactivities 1
| Assay | Result | Reference |
|---|---|---|
| Experimentally measured binding affinity data (IC50) for protein-ligand complexes derived from PDB | IC50 1.4 uM | PMID:24446431 |
Open questions 1
shared-structure — This structure is reported by more than one MIBiG entry: BGC0000890, BGC0000891, BGC0001465. Confirm they describe the same compound rather than an upstream cross-reference error.
Provenance
| Source concept | Source | Version |
|---|---|---|
| BGC0000891 | MIBIG | 4 |
| BGC0000890 | MIBIG | 5 |
| BGC0001465 | MIBIG | 5 |
This page is generated from data/natural_products/shikimates_and_phenylpropanoids/pentabromopseudilin.yaml, which is generated from the committed inventories. Neither is edited by hand.