| BioID | bio1314 |
|---|
| Name | AMYRISIN C |
|---|
| ChEMBL ID | CHEMBL2023533 |
|---|
| Molecular Formula | C22H22O7 |
|---|
| Molecular Weight | 398.41 |
|---|
| Molecular Weight (Monoisotopic) | 398.1366 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Amyrisin C |
|---|
| Smiles | COc1cc(-c2cc(=O)c3c(O)c(OC)c(O)cc3o2)ccc1OCC=C(C)C |
|---|
| Inchi | InChI=1S/C22H22O7/c1-12(2)7-8-28-16-6-5-13(9-18(16)26-3)17-10-14(23)20-19(29-17)11-15(24)22(27-4)21(20)25/h5-7,9-11,24-25H,8H2,1-4H3 |
|---|
| Inchi Key | ABZZDWBIZJSCNU-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 4.0 |
|---|
| Np Likeness Score | 1.38 |
|---|
| Records Key | ['3, Amyrisin C'] |
|---|
| Records Name | ['5,7-dihydroxy-6-methoxy-2-(3-methoxy-4-((3-methylbut-2-en-1-yl)oxy)phenyl)-4H-chromen-4-one'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
