Bioactive Compound Details
| BioID | bio198017 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1080237 |
| Molecular Formula | C16H20O3 |
| Molecular Weight | 260.33 |
| Molecular Weight (Monoisotopic) | 260.1412 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | (1'R,2'S)-Candenatenin D |
| Smiles | CO[C@H]1CC(=O)CC[C@@]1(O)C/C=C/c1ccccc1 |
| Inchi | InChI=1S/C16H20O3/c1-19-15-12-14(17)9-11-16(15,18)10-5-8-13-6-3-2-4-7-13/h2-8,15,18H,9-12H2,1H3/b8-5+/t15-,16-/m0/s1 |
| Inchi Key | KFMVODFIRJNHQI-TWZSPHTKSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | 1.99 |
| Records Key | ['4'] |
| Records Name | [(1'R,2'S)-Candenatenin D"]" |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
