| BioID | bio1014 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1683258 |
|---|
| Molecular Formula | C28H38O4 |
|---|
| Molecular Weight | 438.61 |
|---|
| Molecular Weight (Monoisotopic) | 438.277 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | 3,3,5-Triisobutyldesmosdumotin C |
|---|
| Smiles | COC1=C(CC(C)C)C(=O)/C(=C(O)/C=C/c2ccccc2)C(=O)C1(CC(C)C)CC(C)C |
|---|
| Inchi | InChI=1S/C28H38O4/c1-18(2)15-22-25(30)24(23(29)14-13-21-11-9-8-10-12-21)26(31)28(16-19(3)4,17-20(5)6)27(22)32-7/h8-14,18-20,29H,15-17H2,1-7H3/b14-13+,24-23+ |
|---|
| Inchi Key | NXYNBZYSMLNHAD-KFGDZIEPSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 8.0 |
|---|
| Bioactivities | 8.0 |
|---|
| Np Likeness Score | 1.05 |
|---|
| Records Key | ['22'] |
|---|
| Records Name | ['3,3,5-Triisobutyldesmosdumotin C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
