| BioID | bio367 |
|---|
| Name | PIERREIONE C |
|---|
| ChEMBL ID | CHEMBL1773674 |
|---|
| Molecular Formula | C27H28O6 |
|---|
| Molecular Weight | 448.52 |
|---|
| Molecular Weight (Monoisotopic) | 448.1886 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Pierreione C |
|---|
| Smiles | COc1cc(-c2coc3cc4c(c(OC)c3c2=O)C=CC(C)(C)O4)ccc1OCC=C(C)C |
|---|
| Inchi | InChI=1S/C27H28O6/c1-16(2)10-12-31-20-8-7-17(13-22(20)29-5)19-15-32-23-14-21-18(9-11-27(3,4)33-21)26(30-6)24(23)25(19)28/h7-11,13-15H,12H2,1-6H3 |
|---|
| Inchi Key | FDPHNMKJMRWIBY-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 1.0 |
|---|
| Np Likeness Score | 1.85 |
|---|
| Records Key | ['3, Pierreione C'] |
|---|
| Records Name | [3',5-dimethoxy-4'-O-(3-methyl-2-butenyl)-3'',3''-dimethylpyrano-(6,7)-isoflavone"]" |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
