Bioactive Compound Details
| BioID | bio914 |
|---|---|
| Name | OCHRACEOLIDE C |
| ChEMBL ID | CHEMBL519879 |
| Molecular Formula | C30H42O4 |
| Molecular Weight | 466.66 |
| Molecular Weight (Monoisotopic) | 466.3083 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | ochraceolide C |
| Smiles | C=C1C(=O)O[C@@H]2C[C@]3(C)CC[C@]4(C)[C@@H](CC[C@@H]5[C@@]6(C)CCC(=O)C(C)(C)[C@@H]6C(=O)C[C@]54C)[C@@H]3[C@H]12 |
| Inchi | InChI=1S/C30H42O4/c1-16-22-19(34-25(16)33)15-27(4)12-13-29(6)17(23(22)27)8-9-20-28(5)11-10-21(32)26(2,3)24(28)18(31)14-30(20,29)7/h17,19-20,22-24H,1,8-15H2,2-7H3/t17-,19+,20+,22+,23+,24-,27-,28+,29+,30+/m0/s1 |
| Inchi Key | BZYBPXXQSABSLD-POUSFQHBSA-N |
| Molecular Species | NEUTRAL |
| Targets | 3.0 |
| Bioactivities | 8.0 |
| Np Likeness Score | 3.19 |
| Records Key | ['3, ochraceolide C'] |
| Records Name | ['3,6-dioxolup-20(29)-en-30,21alpha-olide'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
