Bioactive Compound Details
| BioID | bio347 |
|---|---|
| Name | BALSAMINOL C |
| ChEMBL ID | CHEMBL1254762 |
| Molecular Formula | C30H46O4 |
| Molecular Weight | 470.69 |
| Molecular Weight (Monoisotopic) | 470.3396 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Balsaminol C |
| Smiles | CC(C)=CC(=O)C[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3C(=O)C=C4[C@@H](CC[C@H](O)[C@]4(C)CO)[C@]3(C)CC[C@]12C |
| Inchi | InChI=1S/C30H46O4/c1-18(2)14-20(32)15-19(3)21-10-11-30(7)26-24(33)16-23-22(8-9-25(34)28(23,5)17-31)27(26,4)12-13-29(21,30)6/h14,16,19,21-22,25-26,31,34H,8-13,15,17H2,1-7H3/t19-,21-,22-,25+,26-,27+,28-,29-,30+/m1/s1 |
| Inchi Key | OXQKEJMRPYQVRC-UGYWPJPOSA-N |
| Molecular Species | NEUTRAL |
| Targets | 5.0 |
| Bioactivities | 16.0 |
| Np Likeness Score | 3.37 |
| Records Key | ['3', '1, Balsaminol C'] |
| Records Name | ['Balsaminol C', 'cucurbita-5,24-diene-7,23-dione-3beta,29-diol'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
