| BioID | bio1280 |
|---|
| Name | ZINAGRANDINOLIDE C |
|---|
| ChEMBL ID | CHEMBL517794 |
|---|
| Molecular Formula | C21H26O8 |
|---|
| Molecular Weight | 406.43 |
|---|
| Molecular Weight (Monoisotopic) | 406.1628 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Zinagrandinolide C |
|---|
| Smiles | C=C[C@@]1(C)[C@H]2OC(=O)C(=C)[C@H]([C@@H]2OC(C)=O)[C@H](OC(=O)C(C)(C)O)[C@@H]1C(=C)C=O |
|---|
| Inchi | InChI=1S/C21H26O8/c1-8-21(7)14(10(2)9-22)15(28-19(25)20(5,6)26)13-11(3)18(24)29-17(21)16(13)27-12(4)23/h8-9,13-17,26H,1-3H2,4-7H3/t13-,14-,15-,16-,17-,21+/m0/s1 |
|---|
| Inchi Key | YLSANYPALPIPQU-DYZKBYPLSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | 2.96 |
|---|
| Records Key | ['3, Zinagrandinolide C'] |
|---|
| Records Name | [6R*-(2''-hydroxybutanoyloxy)-8S*-acetoxy-15-oxo-1(2),3,11(13)-elemantrien-12,9-olide"]" |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
