Seselidiol
Representations & DB's id
| ||
| ChEBI: | CHEBI:66471 | |
|---|---|---|
| ChEMBL: | CHEMBL463807 | |
| PubChem: | 6438621 | |
| IUPAC: | (8Z)-heptadeca-1,8-dien-4,6-diyne-3,10-diol | |
| Standard InChI: | InChI=1S/C17H24O2/c1-3-5-6-7-11-14-17(19)15-12-9-8-10-13-16(18)4-2/h4,12,15-19H,2-3,5-7,11,14H2,1H3/b15-12- | |
| Standard InChI Key: | DSVMWGREWREVQQ-QINSGFPZSA-N | |
| SMILES: | CCCCCCCC(/C=CC#CC#CC(C=C)O)O | |
Molecular propeties
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| AlogP: | 2.82 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 8 | |
| Number of rings: | 0 | |
| Molecular Weight: | 260.18 | |
| Topological polar surface area: | 40.5 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.529 | |
| Number of carbons: | 17 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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