aphidicolan-16β-ol
naturalproductmech:mibig-1e5a3884b3 MINTED SEEDED
Structure
| Standard InChIKey | ODCPNBCPLWJVQI-NHWXPXPKSA-N |
|---|---|
| SMILES | C[C@]12CCCC([C@@H]1CC[C@@H]3[C@@]24CC[C@@]([C@@H](C3)C4)(C)O)(C)C |
| Stereochemistry | fully defined |
| Cross-references | pubchem:443480, CHEBI:29519 |
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 terpene, 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 betae NCBITaxon:1979465 |
SOURCE_ASSERTION | mibig:BGC0000676 | PMID:14745177 |
Occurrences 0
None cited.
Biosynthetic gene clusters 1
| Accession | Host | Locus evidence | Genome |
|---|---|---|---|
| mibig:BGC0000676 | Phoma betae NCBITaxon:1979465 |
CLUSTER_DEMONSTRATED | genbank:AB114137.1 |
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.
Open questions 1
structure-disagreement — MIBiG cross-references this compound to CHEBI:29519, but ChEBI holds CHEBI:29519 with Standard InChIKey ODCPNBCPLWJVQI-AEVHBADWSA-N and this record's structure is ODCPNBCPLWJVQI-NHWXPXPKSA-N. The skeleton blocks match, so the two disagree about stereochemistry: check which configuration the primary literature supports.
Provenance
| Source concept | Source | Version |
|---|---|---|
| BGC0000676 | MIBIG | 5 |
This page is generated from data/natural_products/terpenoids/aphidicolan-16-ol.yaml, which is generated from the committed inventories. Neither is edited by hand.