Bioactive Compound Details
| BioID | bio408 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL409652 |
| Molecular Formula | C28H24O3 |
| Molecular Weight | 408.5 |
| Molecular Weight (Monoisotopic) | 408.1725 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | 17-Dehydroxyriccardin C |
| Smiles | Oc1ccc2cc1Oc1ccc(cc1)CCc1ccccc1-c1ccc(cc1O)CC2 |
| Inchi | InChI=1S/C28H24O3/c29-26-16-11-21-6-5-20-10-15-25(27(30)17-20)24-4-2-1-3-22(24)12-7-19-8-13-23(14-9-19)31-28(26)18-21/h1-4,8-11,13-18,29-30H,5-7,12H2 |
| Inchi Key | OAEVJFPPXJHCKV-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 10.0 |
| Np Likeness Score | 1.57 |
| Records Key | ['20b', '20', '31'] |
| Records Name | ['17-dehydroxyriccardin C', '14-oxapentacyclo[20.2.2.2^{10,13}.1^{15,19}.0^{2,7}]nonacosa-1(24),2,4,6,10,12,15(27),16,18,22,25,28-dodecaene-16,24-diol', '14-oxapentacyclo[20.2.2.2^{10,13}.1^{15,19}.0^{2,7}]nonacosa-1(24),2,4,6,10,12,15(27),16,18,22,25,28-dodecaene-16,24-diol'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
