Bioactive Compound Details
| BioID | bio620 |
|---|---|
| Name | GEMICHALCONES C |
| ChEMBL ID | CHEMBL499860 |
| Molecular Formula | C30H28O9 |
| Molecular Weight | 532.55 |
| Molecular Weight (Monoisotopic) | 532.1733 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Gemichalcones C |
| Smiles | COc1cc(/C=C/C(=O)OC/C(C)=C\Cc2c(O)ccc(C(=O)/C=C/c3ccc(O)cc3O)c2O)ccc1O |
| Inchi | InChI=1S/C30H28O9/c1-18(17-39-29(36)14-5-19-4-11-26(34)28(15-19)38-2)3-9-22-25(33)13-10-23(30(22)37)24(32)12-7-20-6-8-21(31)16-27(20)35/h3-8,10-16,31,33-35,37H,9,17H2,1-2H3/b12-7+,14-5+,18-3- |
| Inchi Key | OFKHJNZDWNKYOY-DBLNWHOKSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | 1.16 |
| Records Key | ['5'] |
| Records Name | ['gemichalcones C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
