Bioactive Compound Details
| BioID | bio63 |
|---|---|
| Name | SOOTEPIN C |
| ChEMBL ID | CHEMBL557248 |
| Molecular Formula | C31H50O3 |
| Molecular Weight | 470.74 |
| Molecular Weight (Monoisotopic) | 470.376 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Sootepin C |
| Smiles | C=C(CO)[C@@H]1CC[C@@H]2[C@]3(CC[C@]4(C)[C@@H]([C@H](C)CCC=C(C)C)CC[C@@]24C)C[C@]13CCC(=O)OC |
| Inchi | InChI=1S/C31H50O3/c1-21(2)9-8-10-22(3)24-13-15-29(6)26-12-11-25(23(4)19-32)30(16-14-27(33)34-7)20-31(26,30)18-17-28(24,29)5/h9,22,24-26,32H,4,8,10-20H2,1-3,5-7H3/t22-,24-,25+,26+,28-,29+,30-,31+/m1/s1 |
| Inchi Key | KURYSRIIUXRKKX-QDLXANKQSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 5.0 |
| Np Likeness Score | 3.23 |
| Records Key | ['3'] |
| Records Name | ['Sootepin C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
