| BioID | bio1068 |
|---|
| Name | RABDOKUNMIN C |
|---|
| ChEMBL ID | CHEMBL511464 |
|---|
| Molecular Formula | C20H30O5 |
|---|
| Molecular Weight | 350.46 |
|---|
| Molecular Weight (Monoisotopic) | 350.2093 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Rabdokunmin C |
|---|
| Smiles | C=C1C(=O)[C@@]23[C@H](O)C[C@@H]4[C@@](C)(CO)CCC[C@@]4(C)[C@@H]2C[C@H](O)[C@@H]1[C@H]3O |
|---|
| Inchi | InChI=1S/C20H30O5/c1-10-15-11(22)7-13-19(3)6-4-5-18(2,9-21)12(19)8-14(23)20(13,16(10)24)17(15)25/h11-15,17,21-23,25H,1,4-9H2,2-3H3/t11-,12+,13-,14+,15+,17+,18+,19+,20-/m0/s1 |
|---|
| Inchi Key | LHIPFIWSRZRQBF-CQUQCLBPSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 9.0 |
|---|
| Bioactivities | 9.0 |
|---|
| Np Likeness Score | 3.54 |
|---|
| Records Key | ['12', '10', '14', '1'] |
|---|
| Records Name | ['Rabdokunmin C', '(1R,2R,4S,5S,9R,10S,12S,13R,16R)-2,12,16-trihydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0^{1,10}.0^{4,9}]hexadecan-15-one', 'rabdokunmin C', 'Rabdokunmin C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
