| BioID | bio557 |
|---|
| Name | CADIOLIDE C |
|---|
| ChEMBL ID | CHEMBL2204150 |
|---|
| Molecular Formula | C24H12Br4O6 |
|---|
| Molecular Weight | 715.97 |
|---|
| Molecular Weight (Monoisotopic) | 711.7367 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Cadiolide C |
|---|
| Smiles | O=C1O/C(=C\c2ccc(O)c(Br)c2)C(c2ccc(O)c(Br)c2)=C1C(=O)c1cc(Br)c(O)c(Br)c1 |
|---|
| Inchi | InChI=1S/C24H12Br4O6/c25-13-5-10(1-3-17(13)29)6-19-20(11-2-4-18(30)14(26)7-11)21(24(33)34-19)22(31)12-8-15(27)23(32)16(28)9-12/h1-9,29-30,32H/b19-6- |
|---|
| Inchi Key | KKSJLDNZJFUGNY-SWNXQHNESA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 16.0 |
|---|
| Bioactivities | 31.0 |
|---|
| Np Likeness Score | 0.73 |
|---|
| Records Key | ['5', '6f, cadiolide C', 'Cadiolide C'] |
|---|
| Records Name | ['Cadiolide C', '(Z)-5-(3-bromo-4-hydroxybenzylidene)-4-(3-bromo-4-hydroxyphenyl)-3-(3,5-dibromo-4-hydroxybenzoyl)furan-2(5H)-one', 'Cadiolide C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
