Bioactive Compound Details
| BioID | bio255 |
|---|---|
| Name | RUBRIFLORIN C |
| ChEMBL ID | CHEMBL387967 |
| Molecular Formula | C31H36O10 |
| Molecular Weight | 568.62 |
| Molecular Weight (Monoisotopic) | 568.2308 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Rubriflorin C |
| Smiles | CCOC(=O)C[C@H]1OC(C)(C)C2=C1C[C@]13CC[C@]4(C)C(=O)[C@@H](C)[C@@H]5[C@H]6OC(=O)[C@@H](C)[C@H]6O[C@@](O1)(C(=O)C3=CC2=O)[C@@H]54 |
| Inchi | InChI=1S/C31H36O10/c1-7-37-19(33)11-18-15-12-30-9-8-29(6)24-20(13(2)25(29)34)23-22(14(3)27(36)38-23)40-31(24,41-30)26(35)16(30)10-17(32)21(15)28(4,5)39-18/h10,13-14,18,20,22-24H,7-9,11-12H2,1-6H3/t13-,14-,18+,20+,22+,23+,24-,29-,30-,31-/m0/s1 |
| Inchi Key | NGRMPILGZOCJFL-KWPZRPCSSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 2.68 |
| Records Key | ['3'] |
| Records Name | ['rubriflorin C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
