Glycybenzofuran
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL1223582 | |
| PubChem: | 46934435 | |
| IUPAC: | 4-(6-hydroxy-3-methyl-1-benzofuran-2-yl)-5-methoxy-6-(3-methylbut-2-enyl)benzene-1,3-diol | |
| Standard InChI: | InChI=1S/C21H22O5/c1-11(2)5-7-15-16(23)10-17(24)19(21(15)25-4)20-12(3)14-8-6-13(22)9-18(14)26-20/h5-6,8-10,22-24H,7H2,1-4H3 | |
| Standard InChI Key: | OEIIVGQLDAYZNT-UHFFFAOYSA-N | |
| SMILES: | COc1c(CC=C(C)C)c(O)cc(c1c1oc2c(c1C)ccc(c2)O)O | |
Molecular propeties
| ||
| AlogP: | 5.04 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 3 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 3 | |
| Molecular Weight: | 354.15 | |
| Topological polar surface area: | 83.1 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.238 | |
| Number of carbons: | 21 | |