| BioID | bio672 |
|---|
| Name | TSANGIN C |
|---|
| ChEMBL ID | CHEMBL1821992 |
|---|
| Molecular Formula | C24H30O9 |
|---|
| Molecular Weight | 462.5 |
|---|
| Molecular Weight (Monoisotopic) | 462.189 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Tsangin C |
|---|
| Smiles | COc1cc(C(=O)O[C@@H](c2cc(OC)c(OC)c(OC)c2)[C@H](C)C(C)=O)cc(OC)c1OC |
|---|
| Inchi | InChI=1S/C24H30O9/c1-13(14(2)25)21(15-9-17(27-3)22(31-7)18(10-15)28-4)33-24(26)16-11-19(29-5)23(32-8)20(12-16)30-6/h9-13,21H,1-8H3/t13-,21-/m1/s1 |
|---|
| Inchi Key | IGPMFSHAEMUEMC-LRTDBIEQSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 2.0 |
|---|
| Np Likeness Score | 0.55 |
|---|
| Records Key | ['8, Tsangin C'] |
|---|
| Records Name | ['(1R,2S)-2-methyl-3-oxo-1-(3,4,5-trimethoxyphenyl)butyl 3,4,5-trimethoxybenzoate'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
