Eugenyl Acetate
Representations & DB's id
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| ChEBI: | CHEBI:34522 | |
|---|---|---|
| ChEMBL: | CHEMBL108299 | |
| PubChem: | 7136 | |
| IUPAC: | (2-methoxy-4-prop-2-enylphenyl) acetate | |
| Standard InChI: | InChI=1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4,6-8H,1,5H2,2-3H3 | |
| Standard InChI Key: | SCCDQYPEOIRVGX-UHFFFAOYSA-N | |
| SMILES: | C=CCc1ccc(c(c1)OC)OC(=O)C | |
Molecular propeties
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| AlogP: | 2.35 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 1 | |
| Molecular Weight: | 206.09 | |
| Topological polar surface area: | 35.5 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.25 | |
| Number of carbons: | 12 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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