| BioID | bio1516 |
|---|
| Name | BUTYRAXANTHONE C |
|---|
| ChEMBL ID | CHEMBL562167 |
|---|
| Molecular Formula | C28H32O7 |
|---|
| Molecular Weight | 480.56 |
|---|
| Molecular Weight (Monoisotopic) | 480.2148 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | butyraxanthone C |
|---|
| Smiles | CC(C)=CCc1c(O)cc2oc3c(CC=C(C)C)c(O)c4c(c3c(=O)c2c1O)CC(O)C(C)(C)O4 |
|---|
| Inchi | InChI=1S/C28H32O7/c1-13(2)7-9-15-18(29)12-19-22(23(15)31)25(33)21-17-11-20(30)28(5,6)35-27(17)24(32)16(26(21)34-19)10-8-14(3)4/h7-8,12,20,29-32H,9-11H2,1-6H3 |
|---|
| Inchi Key | FSQCKCTZUMXJGJ-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 1.0 |
|---|
| Np Likeness Score | 2.43 |
|---|
| Records Key | ['3, butyraxanthone C'] |
|---|
| Records Name | ['2,5,9,11-tetrahydroxy-3,3-dimethyl-6,10-bis(3-methylbut-2-en-1-yl)-2,3-dihydropyrano[3,2-a]xanthen-12(1H)-one'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
