Molecule Details
| InChIKey | PHBPDHFIJFLEGD-QXYLURSYSA-N |
|---|---|
| Compound Name | Ergost-2-en-26-oic acid, 5,6-epoxy-4,16,20,22,23-pentahydroxy-1-oxo-, gamma-lactone, (4beta,5beta,6beta,16beta,22R,23R,25R)- |
| Canonical SMILES | C[C@H]1[C@H]([C@@H](O)[C@](C)(O)[C@H]2[C@@H](O)C[C@H]3[C@@H]4C[C@H]5O[C@]56[C@@H](O)C=CC(=O)[C@]6(C)[C@H]4CC[C@]23C)OC(=O)[C@@H]1C |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.32 |
| Source | ChEMBL |
2D Structure
Activity Profile