aculin A
naturalproductmech:mibig-1deac30423 MINTED SEEDED
Structure
| Standard InChIKey | CFQDQANDWNCASC-XOGGWNPGSA-N |
|---|---|
| SMILES | CCC1=CC(=O)[C@@]2(C1=CC=C(C[C@@H]2OC(=O)C3CCCN3C(=O)CC4COC(CC4=O)O)C)C |
| Stereochemistry | undefined stereocentres — the InChIKey does not distinguish this compound from its stereoisomers |
| Cross-references | npatlas:NPA011264 |
Filing pathway
Terpenoids — 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 aculeatus ATCC 16872 NCBITaxon:690307 |
SOURCE_ASSERTION | mibig:BGC0002229 | DOI:10.3390/molecules15117985 |
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 aculeatus NCBITaxon:5053 |
LOTUS | DOI:10.1002/CBIC.201500210 |
Biosynthetic gene clusters 1
| Accession | Host | Locus evidence | Genome |
|---|---|---|---|
| mibig:BGC0002229 | Aspergillus aculeatus ATCC 16872 NCBITaxon:690307 |
CLUSTER_UNSTATED | genbank:KV878982.1 |
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 |
|---|---|---|
| BGC0002229 | MIBIG | 2 |
This page is generated from data/natural_products/terpenoids/aculin-a.yaml, which is generated from the committed inventories. Neither is edited by hand.