Ethyl (9Z,12Z,15Z)-Octadeca-9,12,15-Trienoate
Representations & DB's id
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| ChEBI: | CHEBI:84851 | |
|---|---|---|
| ChEMBL: | CHEMBL2005772 | |
| PubChem: | 5367460 | |
| IUPAC: | ethyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate | |
| Standard InChI: | InChI=1S/C20H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12H,3-4,7,10,13-19H2,1-2H3/b6-5-,9-8-,12-11- | |
| Standard InChI Key: | JYYFMIOPGOFNPK-AGRJPVHOSA-N | |
| SMILES: | CC/C=CC/C=CC/C=CCCCCCCCC(=O)OCC | |
Molecular propeties
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| AlogP: | 6.14 | |
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| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 14 | |
| Number of rings: | 0 | |
| Molecular Weight: | 306.26 | |
| Topological polar surface area: | 26.3 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.65 | |
| Number of carbons: | 20 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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