Bioactive Compound Details
| BioID | bio2267 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL377673 |
| Molecular Formula | C15H20O6 |
| Molecular Weight | 296.32 |
| Molecular Weight (Monoisotopic) | 296.126 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | Artemisitone-9 |
| Smiles | C[C@@H]1C(=O)C[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1C32OO4 |
| Inchi | InChI=1S/C15H20O6/c1-7-9-4-5-14(3)19-13-15(9,21-20-14)10(6-11(7)16)8(2)12(17)18-13/h7-10,13H,4-6H2,1-3H3/t7-,8+,9-,10-,13+,14-,15?/m0/s1 |
| Inchi Key | UKQYESKOGRCWMK-WXPGJTHGSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 3.52 |
| Records Key | ['2'] |
| Records Name | ['artemisitone-9'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
