Bioactive Compound Details
| BioID | bio1680 |
|---|---|
| Name | BROUSSONETONE C |
| ChEMBL ID | CHEMBL577801 |
| Molecular Formula | C23H36O4 |
| Molecular Weight | 376.54 |
| Molecular Weight (Monoisotopic) | 376.2614 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Broussonetone C |
| Smiles | CC1(C)OC[C@]2(C[C@]34C[C@@H]2CC[C@H]3[C@]2(C)CCCC(C)(C)[C@H]2C(=O)[C@H]4O)O1 |
| Inchi | InChI=1S/C23H36O4/c1-19(2)9-6-10-21(5)15-8-7-14-11-22(15,18(25)16(24)17(19)21)12-23(14)13-26-20(3,4)27-23/h14-15,17-18,25H,6-13H2,1-5H3/t14-,15-,17+,18+,21-,22+,23-/m0/s1 |
| Inchi Key | GPDYNSLXYAITQJ-SKUUYEPTSA-N |
| Molecular Species | NEUTRAL |
| Targets | 3.0 |
| Bioactivities | 5.0 |
| Np Likeness Score | 3.26 |
| Records Key | ['3, Broussonetone C'] |
| Records Name | ['7alpha,16alpha,17-trihydroxy-ent-kauran-6-one 16,17-acetonide'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
