didemnin B
naturalproductmech:mibig-c33373024b MINTED SEEDED
Structure
| Standard InChIKey | KYHUYMLIVQFXRI-XYUQHQMCSA-N |
|---|---|
| SMILES | CC[C@H](C)[C@@H]1[C@H](CC(=O)O[C@H](C(=O)[C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]3CCCN3C(=O)C(C)O)C)CC4=CC=C(C=C4)OC)C)CC(C)C)C)C(C)C)O |
| Stereochemistry | undefined stereocentres — the InChIKey does not distinguish this compound from its stereoisomers |
| Cross-references | pubchem:13895197 |
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 nrps, 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 |
|---|---|---|---|
| Tistrella mobilis KA081020-065 NCBITaxon:1110502 |
SOURCE_ASSERTION | mibig:BGC0000985 | PMID:22458477 |
Occurrences 0
None cited.
Biosynthetic gene clusters 1
| Accession | Host | Locus evidence | Genome |
|---|---|---|---|
| mibig:BGC0000985 | Tistrella mobilis KA081020-065 NCBITaxon:1110502 |
CLUSTER_UNSTATED | genbank:CP003239.1 |
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 |
|---|---|---|
| BGC0000985 | MIBIG | 5 |
This page is generated from data/natural_products/unclassified/didemnin-b.yaml, which is generated from the committed inventories. Neither is edited by hand.