| BioID | bio1372 |
|---|
| Name | BOERAVINONE C |
|---|
| ChEMBL ID | CHEMBL426722 |
|---|
| Molecular Formula | C18H16O7 |
|---|
| Molecular Weight | 344.32 |
|---|
| Molecular Weight (Monoisotopic) | 344.0896 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Boeravinone C |
|---|
| Smiles | COc1cc2c(c(O)c1C)C(=O)[C@]1(O)c3cccc(O)c3OC[C@H]1O2 |
|---|
| Inchi | InChI=1S/C18H16O7/c1-8-11(23-2)6-12-14(15(8)20)17(21)18(22)9-4-3-5-10(19)16(9)24-7-13(18)25-12/h3-6,13,19-20,22H,7H2,1-2H3/t13-,18+/m1/s1 |
|---|
| Inchi Key | ZVSXALWTWGTZSP-ACJLOTCBSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 2.0 |
|---|
| Np Likeness Score | 2.33 |
|---|
| Records Key | ['8', '6'] |
|---|
| Records Name | ['boeravinone C', 'boeravinone C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
