Bioactive Compound Details
| BioID | bio1155 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL2332127 |
| Molecular Formula | C30H42O5 |
| Molecular Weight | 482.66 |
| Molecular Weight (Monoisotopic) | 482.3032 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Rel-Carinatin C |
| Smiles | C=C1C(=O)O[C@@H]2C[C@@H]3[C@]4(CC[C@]5(C)[C@@H]([C@H](C)CC(=O)C=C(C)C)CC[C@@]35C)C[C@]4(CCC(=O)O)[C@H]12 |
| Inchi | InChI=1S/C30H42O5/c1-17(2)13-20(31)14-18(3)21-7-9-28(6)23-15-22-25(19(4)26(34)35-22)30(10-8-24(32)33)16-29(23,30)12-11-27(21,28)5/h13,18,21-23,25H,4,7-12,14-16H2,1-3,5-6H3,(H,32,33)/t18-,21-,22-,23+,25-,27-,28+,29+,30-/m1/s1 |
| Inchi Key | ZDQKEBHQSZETLM-VVYDSIJPSA-N |
| Molecular Species | ACID |
| Targets | 10.0 |
| Bioactivities | 11.0 |
| Np Likeness Score | 3.41 |
| Records Key | ['3'] |
| Records Name | ['rel-Carinatin C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
