Molecule Details
| InChIKey | ZEECICMMDUHSOU-XPZAPRPFSA-N |
|---|---|
| Compound Name | [(1S,2S,5S,6R,7R,9S,10S,18R)-5-acetyloxy-6-(benzoyloxymethyl)-18-hydroxy-2,6,10-trimethyl-16-oxo-14-pyridin-3-yl-11,15-dioxatetracyclo[8.8.0.02,7.012,17]octadeca-12(17),13-dien-9-yl] 4-cyanobenzoate |
| Canonical SMILES | CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](C[C@H](OC(=O)c3ccc(C#N)cc3)[C@@]3(C)Oc4cc(-c5cccnc5)oc(=O)c4[C@H](O)[C@H]23)[C@]1(C)COC(=O)c1ccccc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.12 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile