pentacitidin B
naturalproductmech:mibig-f1202ed4f6 MINTED SEEDED
Structure
| Standard InChIKey | KEIIWGOWWWRCLH-VKJAPUTGSA-N |
|---|---|
| SMILES | [H]C(C(NC([C@H]1CCCN1C([C@@H](NC([C@@H](NC([C@@H](CC2=CNC=N2)NC(CC3=CC=CC=C3)=O)=O)[C@H](CC)C)=O)C(C)C)=O)=O)CC4=CC=CC=C4)=O |
| Stereochemistry | undefined stereocentres — the InChIKey does not distinguish this compound from its stereoisomers |
Filing pathway
Amino acids and peptides — 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, 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 |
|---|---|---|---|
| Chitinophaga eiseniae NCBITaxon:634771 |
SOURCE_ASSERTION | mibig:BGC0002660 | DOI:10.1021/acschembio.1c00861 |
Occurrences 0
None cited.
Biosynthetic gene clusters 1
| Accession | Host | Locus evidence | Genome |
|---|---|---|---|
| mibig:BGC0002660 | Chitinophaga eiseniae NCBITaxon:634771 |
CLUSTER_UNSTATED | genbank:FUWZ01000001.1 |
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 |
|---|---|---|
| BGC0002660 | MIBIG | 2 |
This page is generated from data/natural_products/amino_acids_and_peptides/pentacitidin-b.yaml, which is generated from the committed inventories. Neither is edited by hand.