2-Hydroxyethyl Octadecanoate
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL2355383 | |
| PubChem: | 24762 | |
| IUPAC: | 2-hydroxyethyl octadecanoate | |
| Standard InChI: | InChI=1S/C20H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)23-19-18-21/h21H,2-19H2,1H3 | |
| Standard InChI Key: | RFVNOJDQRGSOEL-UHFFFAOYSA-N | |
| SMILES: | CCCCCCCCCCCCCCCCCC(=O)OCCO | |
Molecular propeties
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| AlogP: | 5.78 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 18 | |
| Number of rings: | 0 | |
| Molecular Weight: | 328.3 | |
| Topological polar surface area: | 46.5 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.95 | |
| Number of carbons: | 20 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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