| BioID | bio198952 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL2178880 |
|---|
| Molecular Formula | C12H24O3 |
|---|
| Molecular Weight | 216.32 |
|---|
| Molecular Weight (Monoisotopic) | 216.1725 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | (S)-Octyl 2-Hydroxybutanoate |
|---|
| Smiles | CCCCCCCCOC(=O)[C@@H](O)CC |
|---|
| Inchi | InChI=1S/C12H24O3/c1-3-5-6-7-8-9-10-15-12(14)11(13)4-2/h11,13H,3-10H2,1-2H3/t11-/m0/s1 |
|---|
| Inchi Key | IFQMZNJKZHSPSP-NSHDSACASA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 3.0 |
|---|
| Np Likeness Score | 0.76 |
|---|
| Records Key | ['7'] |
|---|
| Records Name | ['(S)-octyl 2-hydroxybutanoate'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
