| BioID | bio1739 |
|---|
| Name | CALOPOLYANOLIDES C |
|---|
| ChEMBL ID | CHEMBL456747 |
|---|
| Molecular Formula | C25H26O5 |
|---|
| Molecular Weight | 406.48 |
|---|
| Molecular Weight (Monoisotopic) | 406.178 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | calopolyanolides C |
|---|
| Smiles | CC(C)=CCc1c(O)c2c(c3c1OC(=O)C[C@H]3c1ccccc1)O[C@@H](C)[C@H](C)C2=O |
|---|
| Inchi | InChI=1S/C25H26O5/c1-13(2)10-11-17-23(28)21-22(27)14(3)15(4)29-25(21)20-18(12-19(26)30-24(17)20)16-8-6-5-7-9-16/h5-10,14-15,18,28H,11-12H2,1-4H3/t14-,15-,18-/m0/s1 |
|---|
| Inchi Key | GDBZTZISXRIMID-MPGHIAIKSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 1.0 |
|---|
| Np Likeness Score | 2.06 |
|---|
| Records Key | ['1, calopolyanolides C'] |
|---|
| Records Name | ['5-hydroxy-2alpha,3beta-dimethyl-6-(3-methylbut-2-enyl)-10alpha-phenyl-2,3,9,10-tetrahydropyrano[2,3-f]chromen-4,8-dione'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
