Bioactive Compound Details
| BioID | bio1561 |
|---|---|
| Name | BLEPHAROCALYXIN C |
| ChEMBL ID | CHEMBL448211 |
| Molecular Formula | C38H42O7 |
| Molecular Weight | 610.75 |
| Molecular Weight (Monoisotopic) | 610.2931 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Blepharocalyxin C |
| Smiles | Oc1ccc(/C=C/[C@H](C[C@@H](O)CCc2ccc(O)cc2)[C@@H]2[C@@H](c3ccc(O)cc3)O[C@@H](CCc3ccc(O)cc3)C[C@@H]2O)cc1 |
| Inchi | InChI=1S/C38H42O7/c39-30-13-2-25(3-14-30)1-10-29(23-34(43)19-8-26-4-15-31(40)16-5-26)37-36(44)24-35(22-9-27-6-17-32(41)18-7-27)45-38(37)28-11-20-33(42)21-12-28/h1-7,10-18,20-21,29,34-44H,8-9,19,22-24H2/b10-1+/t29-,34+,35+,36+,37+,38-/m1/s1 |
| Inchi Key | OCGXHNIZNJTINO-XKXZSYDMSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 1.38 |
| Records Key | ['5'] |
| Records Name | ['Blepharocalyxin C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
