Bioactive Compound Details
| BioID | bio198333 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1908077 |
| Molecular Formula | C19H26O4 |
| Molecular Weight | 318.41 |
| Molecular Weight (Monoisotopic) | 318.1831 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-Methoxyestriol |
| Smiles | COc1cc2c(cc1O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)[C@H](O)C[C@@H]12 |
| Inchi | InChI=1S/C19H26O4/c1-19-6-5-11-12(14(19)9-16(21)18(19)22)4-3-10-7-15(20)17(23-2)8-13(10)11/h7-8,11-12,14,16,18,20-22H,3-6,9H2,1-2H3/t11-,12+,14-,16+,18-,19-/m0/s1 |
| Inchi Key | PEXPJFWTSZLEAQ-YSYMNNNUSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 2.4 |
| Records Key | ['2-Methoxyestriol'] |
| Records Name | ['2-Methoxyestriol'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
