| BioID | bio391 |
|---|
| Name | SCHISANTHERIN C |
|---|
| ChEMBL ID | CHEMBL578357 |
|---|
| Molecular Formula | C27H32O9 |
|---|
| Molecular Weight | 500.54 |
|---|
| Molecular Weight (Monoisotopic) | 500.2046 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Schisantherin C |
|---|
| Smiles | C/C=C(\C)C(=O)O[C@H]1c2cc(OC)c(OC)c(OC)c2-c2c(cc3c(c2O)OCO3)C[C@H](C)[C@]1(C)O |
|---|
| Inchi | InChI=1S/C27H32O9/c1-8-13(2)26(29)36-25-16-11-17(31-5)23(32-6)24(33-7)20(16)19-15(9-14(3)27(25,4)30)10-18-22(21(19)28)35-12-34-18/h8,10-11,14,25,28,30H,9,12H2,1-7H3/b13-8+/t14-,25-,27-/m0/s1 |
|---|
| Inchi Key | BYZKFKFGPLUFIH-QHWVUYPCSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 11.0 |
|---|
| Bioactivities | 42.0 |
|---|
| Np Likeness Score | 2.37 |
|---|
| Records Key | ['Schisantherin C', '9', 'Schisantherin C', '6'] |
|---|
| Records Name | ['schisantherin C', 'Schisantherin C', 'Schisantherin C', 'schisantherin C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
