shimalactone A
naturalproductmech:mibig-939fcbb8c7 MINTED SEEDED
Structure
| Standard InChIKey | BNFUGVFXZSYVMT-HEGJJMKQSA-N |
|---|---|
| SMILES | C/C=C(\C)/[C@H]([C@@]1([C@H]2C(=CC(=C[C@]2([C@H]1/C(=C/[C@@]3([C@@H]4[C@H](C(=O)[C@]3(C(=O)O4)C)C)C)/C)C)C)C)C)O |
| Stereochemistry | fully defined |
| Cross-references | npatlas:NPA014121, pubchem:11293939 |
Filing pathway
Unclassified — 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 pks, from MIBiG.
Producer organisms 1
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 |
|---|---|---|---|
| Aspergillus stellatus NCBITaxon:1549217 |
SOURCE_ASSERTION | mibig:BGC0002258 | PMID:32129542 |
Occurrences 1
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 |
|---|---|---|
| Aspergillus stellatus NCBITaxon:1549217 |
LOTUS | DOI:10.1016/J.TET.2005.05.105 |
Biosynthetic gene clusters 1
| Accession | Host | Locus evidence | Genome |
|---|---|---|---|
| mibig:BGC0002258 | Aspergillus stellatus NCBITaxon:1549217 |
CLUSTER_DEMONSTRATED | genbank:LC462123.1 |
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.
Provenance
| Source concept | Source | Version |
|---|---|---|
| BGC0002258 | MIBIG | 3 |
This page is generated from data/natural_products/unclassified/shimalactone-a.yaml, which is generated from the committed inventories. Neither is edited by hand.