Bioactive Compound Details
| BioID | bio1594 |
|---|---|
| Name | BOTRYOLIDES C |
| ChEMBL ID | CHEMBL404396 |
| Molecular Formula | C13H16O6 |
| Molecular Weight | 268.26 |
| Molecular Weight (Monoisotopic) | 268.0947 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Botryolides C |
| Smiles | C[C@@H]1C[C@@H]2O[C@@H]2/C=C/[C@]2(CC(=O)O1)C[C@@H](O)C(=O)O2 |
| Inchi | InChI=1S/C13H16O6/c1-7-4-10-9(18-10)2-3-13(6-11(15)17-7)5-8(14)12(16)19-13/h2-3,7-10,14H,4-6H2,1H3/b3-2+/t7-,8-,9-,10+,13-/m1/s1 |
| Inchi Key | MPBXBRPXWNZKJE-WPTXVMTHSA-N |
| Molecular Species | NEUTRAL |
| Targets | 3.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | 3.11 |
| Records Key | ['3'] |
| Records Name | ['Botryolides C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
