Bioactive Compound Details
| BioID | bio481 |
|---|---|
| Name | STEREONSTEROID C |
| ChEMBL ID | CHEMBL445484 |
| Molecular Formula | C29H46O7 |
| Molecular Weight | 506.68 |
| Molecular Weight (Monoisotopic) | 506.3244 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Stereonsteroid C |
| Smiles | C=C[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O[C@@H]5O[C@@H](C)[C@@H](OC(C)=O)[C@@H](O)[C@@H]5O)CC[C@]4(CO)[C@H]3CC[C@]12C |
| Inchi | InChI=1S/C29H46O7/c1-5-18-7-9-22-21-8-6-19-14-20(10-13-29(19,15-30)23(21)11-12-28(18,22)4)36-27-25(33)24(32)26(16(2)34-27)35-17(3)31/h5,16,18-27,30,32-33H,1,6-15H2,2-4H3/t16-,18-,19-,20-,21-,22-,23-,24-,25-,26+,27-,28+,29+/m0/s1 |
| Inchi Key | INLRWOURCDBPMH-KFHYCKKOSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 3.2 |
| Records Key | ['3'] |
| Records Name | ['Stereonsteroid C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
