Bioactive Compound Details
| BioID | bio198217 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL2178889 |
| Molecular Formula | C11H22O3 |
| Molecular Weight | 202.29 |
| Molecular Weight (Monoisotopic) | 202.1569 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Rac-Heptyl 2-Hydroxybutanoate |
| Smiles | CCCCCCCOC(=O)C(O)CC |
| Inchi | InChI=1S/C11H22O3/c1-3-5-6-7-8-9-14-11(13)10(12)4-2/h10,12H,3-9H2,1-2H3 |
| Inchi Key | KZNUJPSEWPKHFK-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 0.82 |
| Records Key | ['19'] |
| Records Name | ['rac-Heptyl 2-hydroxybutanoate'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
