| BioID | bio1415 |
|---|
| Name | BUSSEIHYDROQUINONE C |
|---|
| ChEMBL ID | CHEMBL2071295 |
|---|
| Molecular Formula | C22H24O5 |
|---|
| Molecular Weight | 368.43 |
|---|
| Molecular Weight (Monoisotopic) | 368.1624 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Busseihydroquinone C |
|---|
| Smiles | COc1cc(C(=O)O)c(O)c2ccc3c(c12)C=CC(C)(CCC=C(C)C)O3 |
|---|
| Inchi | InChI=1S/C22H24O5/c1-13(2)6-5-10-22(3)11-9-14-17(27-22)8-7-15-19(14)18(26-4)12-16(20(15)23)21(24)25/h6-9,11-12,23H,5,10H2,1-4H3,(H,24,25) |
|---|
| Inchi Key | MPFRBGNULMTVEA-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 8.0 |
|---|
| Bioactivities | 10.0 |
|---|
| Np Likeness Score | 2.43 |
|---|
| Records Key | ['3, Busseihydroquinone C', 'Busseihydroquinone C'] |
|---|
| Records Name | [rac-1-hydroxy-4-methoxy-3'-methyl-3'-(4-methylpent-3-enyl)-3H-benzo[f]chromene-2-carboxylic acid", 'Busseihydroquinone C']" |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
