| BioID | bio118 |
|---|
| Name | HYPARGENIN C |
|---|
| ChEMBL ID | CHEMBL519237 |
|---|
| Molecular Formula | C20H26O3 |
|---|
| Molecular Weight | 314.43 |
|---|
| Molecular Weight (Monoisotopic) | 314.1882 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | hypargenin C |
|---|
| Smiles | CC(C)c1cc2c(cc1O)[C@@]1(C)CCCC(C)(C)[C@@H]1C(=O)C2=O |
|---|
| Inchi | InChI=1S/C20H26O3/c1-11(2)12-9-13-14(10-15(12)21)20(5)8-6-7-19(3,4)18(20)17(23)16(13)22/h9-11,18,21H,6-8H2,1-5H3/t18-,20+/m0/s1 |
|---|
| Inchi Key | KVTOPOITUALWOF-AZUAARDMSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 7.0 |
|---|
| Np Likeness Score | 2.14 |
|---|
| Records Key | ['3, hypargenin C'] |
|---|
| Records Name | ['12-hydroxyabieta-8,11-13-triene-6,7-dione'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
