Bioactive Compound Details
| BioID | bio199941 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL383683 |
| Molecular Formula | C20H28O5 |
| Molecular Weight | 348.44 |
| Molecular Weight (Monoisotopic) | 348.1937 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 15-(2'-Methyl)Butyryloxymicrantholide |
| Smiles | C=C1C(=O)O[C@H]2C/C(CO)=C/CC/C(COC(=O)C(C)CC)=C/C[C@H]12 |
| Inchi | InChI=1S/C20H28O5/c1-4-13(2)19(22)24-12-15-6-5-7-16(11-21)10-18-17(9-8-15)14(3)20(23)25-18/h7-8,13,17-18,21H,3-6,9-12H2,1-2H3/b15-8-,16-7+/t13?,17-,18+/m1/s1 |
| Inchi Key | VQRWOFINNQGFFG-IDIVVMMGSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 2.47 |
| Records Key | ['31'] |
| Records Name | [15-(2'-methyl)butyryloxymicrantholide"]" |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
