| BioID | bio199898 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL161908 |
|---|
| Molecular Formula | C14H16O6 |
|---|
| Molecular Weight | 280.28 |
|---|
| Molecular Weight (Monoisotopic) | 280.0947 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-Acetoxy-Benzoic Acid Butyryloxymethyl Ester |
|---|
| Smiles | CCCC(=O)OCOC(=O)c1ccccc1OC(C)=O |
|---|
| Inchi | InChI=1S/C14H16O6/c1-3-6-13(16)18-9-19-14(17)11-7-4-5-8-12(11)20-10(2)15/h4-5,7-8H,3,6,9H2,1-2H3 |
|---|
| Inchi Key | GACFJCOPFMBYKV-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 6.0 |
|---|
| Np Likeness Score | 0.14 |
|---|
| Records Key | ['22'] |
|---|
| Records Name | ['2-Acetoxy-benzoic acid butyryloxymethyl ester'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
