Epsilon-Cotonefuran
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL1080658 | |
| PubChem: | 10334385 | |
| IUPAC: | 3,4,7-trimethoxydibenzofuran-2,6-diol | |
| Standard InChI: | InChI=1S/C15H14O6/c1-18-10-5-4-7-8-6-9(16)14(19-2)15(20-3)13(8)21-12(7)11(10)17/h4-6,16-17H,1-3H3 | |
| Standard InChI Key: | BWNWAKZIGLEKRI-UHFFFAOYSA-N | |
| SMILES: | COc1c(OC)c(O)cc2c1oc1c2ccc(c1O)OC | |
Molecular propeties
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| AlogP: | 3.02 | |
|---|---|---|
| Hydrogen bonds acceptors: | 6 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 3 | |
| Number of rings: | 3 | |
| Molecular Weight: | 290.08 | |
| Topological polar surface area: | 81.3 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.2 | |
| Number of carbons: | 15 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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