| BioID | bio199480 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL163988 |
|---|
| Molecular Formula | C13H14O6 |
|---|
| Molecular Weight | 266.25 |
|---|
| Molecular Weight (Monoisotopic) | 266.079 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-Acetoxy-Benzoic Acid Ethoxycarbonylmethyl Ester |
|---|
| Smiles | CCOC(=O)COC(=O)c1ccccc1OC(C)=O |
|---|
| Inchi | InChI=1S/C13H14O6/c1-3-17-12(15)8-18-13(16)10-6-4-5-7-11(10)19-9(2)14/h4-7H,3,8H2,1-2H3 |
|---|
| Inchi Key | HFSBGVJICLMJRK-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 6.0 |
|---|
| Np Likeness Score | -0.42 |
|---|
| Records Key | ['23'] |
|---|
| Records Name | ['2-Acetoxy-benzoic acid ethoxycarbonylmethyl ester'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
