Bioactive Compound Details
| BioID | bio1217 |
|---|---|
| Name | CAMPHORATIN C |
| ChEMBL ID | CHEMBL1641966 |
| Molecular Formula | C29H42O6 |
| Molecular Weight | 486.65 |
| Molecular Weight (Monoisotopic) | 486.2981 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Camphoratin C |
| Smiles | C=C(CC[C@@H](C)[C@H]1CC[C@H]2C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@@H](O)[C@](C)(O)[C@@H]1CC3=O)C(C)C(=O)O |
| Inchi | InChI=1S/C29H42O6/c1-15(17(3)26(33)34)7-8-16(2)18-9-10-19-24-20(30)13-22-27(4,12-11-23(32)29(22,6)35)25(24)21(31)14-28(18,19)5/h16-19,22-23,32,35H,1,7-14H2,2-6H3,(H,33,34)/t16-,17?,18-,19+,22-,23-,27+,28-,29-/m1/s1 |
| Inchi Key | VQOGQXBQGQLQDY-JUVRMLKSSA-N |
| Molecular Species | ACID |
| Targets | 5.0 |
| Bioactivities | 5.0 |
| Np Likeness Score | 3.0 |
| Records Key | ['3, Camphoratin C', '23'] |
| Records Name | ['(3alpha,4beta-dihydroxy-7,11-dioxo-4alpha-methylergosta-8,24(28)-dien-26-oic acid', 'Camphoratin C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
