| BioID | bio1143 |
|---|
| Name | ALTERPORRIOL C |
|---|
| ChEMBL ID | CHEMBL2011671 |
|---|
| Molecular Formula | C32H26O13 |
|---|
| Molecular Weight | 618.55 |
|---|
| Molecular Weight (Monoisotopic) | 618.1373 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Alterporriol C |
|---|
| Smiles | COc1cc(O)c2c(c1)C(=O)c1cc(C)c(O)c(-c3c(OC)cc4c(c3O)C(=O)C3=C(C4=O)[C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)c1C2=O |
|---|
| Inchi | InChI=1S/C32H26O13/c1-9-5-11-17(26(37)16-12(24(11)35)6-10(44-3)7-14(16)33)20(23(9)34)19-15(45-4)8-13-18(27(19)38)28(39)21-22(25(13)36)30(41)32(2,43)31(42)29(21)40/h5-8,29-31,33-34,38,40-43H,1-4H3/t29-,30+,31+,32-/m0/s1 |
|---|
| Inchi Key | PSGFKGASHCTNSI-BVEPWEIPSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 13.0 |
|---|
| Bioactivities | 18.0 |
|---|
| Np Likeness Score | 1.78 |
|---|
| Records Key | ['22, atropisomer-1', '17'] |
|---|
| Records Name | ['Alterporriol C', 'Alterporriol C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
