Bioactive Compound Details
| BioID | bio197730 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL496873 |
| Molecular Formula | C20H23NO5 |
| Molecular Weight | 357.41 |
| Molecular Weight (Monoisotopic) | 357.1576 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-Demethyldemecolcine |
| Smiles | CN[C@H]1CCc2cc(OC)c(O)c(OC)c2-c2ccc(OC)c(=O)cc21 |
| Inchi | InChI=1S/C20H23NO5/c1-21-14-7-5-11-9-17(25-3)19(23)20(26-4)18(11)12-6-8-16(24-2)15(22)10-13(12)14/h6,8-10,14,21,23H,5,7H2,1-4H3/t14-/m0/s1 |
| Inchi Key | KEOVUWFJHROWNK-AWEZNQCLSA-N |
| Molecular Species | BASE |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 1.35 |
| Records Key | ['4'] |
| Records Name | ['2-demethyldemecolcine'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
