squalestatin S1
naturalproductmech:mibig-867d2111b7 MINTED SEEDED
Structure
| Standard InChIKey | KKQOCSPYLTUDES-KVBVMKTNSA-N |
|---|---|
| SMILES | CC[C@H](C)C[C@H](C)\C=C\C(=O)O[C@@H]1C[C@]2(CCC(=C)[C@@H](OC(C)=O)[C@H](C)CC3=CC=CC=C3)O[C@@]1(C(O)=O)[C@@](O)([C@H](O2)C(O)=O)C(O)=O |
| Stereochemistry | fully defined |
| Cross-references | npatlas:NPA011630 |
Filing pathway
Polyketides — 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 |
|---|---|---|---|
| Phoma sp. MF5453 NCBITaxon:1828523 |
BGC_CHARACTERIZED | mibig:BGC0001339 | DOI:10.1039/c6cc02130a |
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 |
|---|---|---|
| Phoma NCBITaxon:37463 |
LOTUS | DOI:10.1039/C6CC02130A |
| Phoma NCBITaxon:37463 |
LOTUS | DOI:10.7164/ANTIBIOTICS.47.740 |
Biosynthetic gene clusters 1
| Accession | Host | Locus evidence | Genome |
|---|---|---|---|
| mibig:BGC0001339 | Phoma sp. MF5453 NCBITaxon:1828523 |
CLUSTER_DEMONSTRATED | genbank:KU946987.1 |
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 |
|---|---|---|
| BGC0001339 | MIBIG | 5 |
This page is generated from data/natural_products/polyketides/squalestatin-s1.yaml, which is generated from the committed inventories. Neither is edited by hand.