Bioactive Compound Details
| BioID | bio1822 |
|---|---|
| Name | ANTIAROSIDE C |
| ChEMBL ID | CHEMBL1169848 |
| Molecular Formula | C29H42O10 |
| Molecular Weight | 550.65 |
| Molecular Weight (Monoisotopic) | 550.2778 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Antiaroside C |
| Smiles | C[C@@H]1O[C@H](O[C@@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O |
| Inchi | InChI=1S/C29H42O10/c1-15-22(32)23(33)24(34)25(38-15)39-17-3-8-27(14-30)19-4-7-26(2)18(16-11-21(31)37-13-16)6-10-29(26,36)20(19)5-9-28(27,35)12-17/h11,14-15,17-20,22-25,32-36H,3-10,12-13H2,1-2H3/t15-,17+,18+,19-,20+,22-,23+,24+,25+,26+,27-,28-,29-/m0/s1 |
| Inchi Key | HULMNSIAKWANQO-BEVHFQMKSA-N |
| Molecular Species | NEUTRAL |
| Targets | 8.0 |
| Bioactivities | 17.0 |
| Np Likeness Score | 3.14 |
| Records Key | ['27', '3', '23'] |
| Records Name | ['Antiaroside C', 'Antiaroside C', 'Antiaroside C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
