| BioID | bio823 |
|---|
| Name | DESMOSDUMOTIN C |
|---|
| ChEMBL ID | CHEMBL53628 |
|---|
| Molecular Formula | C19H20O4 |
|---|
| Molecular Weight | 312.36 |
|---|
| Molecular Weight (Monoisotopic) | 312.1362 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Desmosdumotin C |
|---|
| Smiles | COC1=C(C)C(O)=C(C(=O)/C=C/c2ccccc2)C(=O)C1(C)C |
|---|
| Inchi | InChI=1S/C19H20O4/c1-12-16(21)15(17(22)19(2,3)18(12)23-4)14(20)11-10-13-8-6-5-7-9-13/h5-11,21H,1-4H3/b11-10+ |
|---|
| Inchi Key | ATPDRDNAXQXSQJ-ZHACJKMWSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 30.0 |
|---|
| Bioactivities | 57.0 |
|---|
| Np Likeness Score | 1.36 |
|---|
| Records Key | ['16', '2', 'SID26725277', '96', '1', '1, desmosdumotin c'] |
|---|
| Records Name | ['2-[(E)-1-Hydroxy-3-phenyl-prop-2-en-(E)-ylidene]-5-methoxy-4,6,6-trimethyl-cyclohex-4-ene-1,3-dione', '2-[(E)-1-Hydroxy-3-phenyl-prop-2-en-(E)-ylidene]-5-methoxy-4,6,6-trimethyl-cyclohex-4-ene-1,3-dione', 'SID26725277', 'Desmosdumotin C', 'Desmosdumotin C', '(E)-2-((E)-1-hydroxy-3-phenylallylidene)-5-methoxy-4,6,6-trimethylcyclohex-4-ene-1,3-dione'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
