6,8-Bis(3-Methylbut-2-Enyl)-9,10-Dihydrophenanthrene-2,3,5,7-Tetrol
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL1535695 | |
| PubChem: | 480818 | |
| IUPAC: | 6,8-bis(3-methylbut-2-enyl)-9,10-dihydrophenanthrene-2,3,5,7-tetrol | |
| Standard InChI: | InChI=1S/C24H28O4/c1-13(2)5-8-17-16-10-7-15-11-20(25)21(26)12-19(15)22(16)24(28)18(23(17)27)9-6-14(3)4/h5-6,11-12,25-28H,7-10H2,1-4H3 | |
| Standard InChI Key: | YJJXCOSDPIJFJR-UHFFFAOYSA-N | |
| SMILES: | CC(=CCc1c(O)c(CC=C(C)C)c2c(c1O)c1cc(O)c(cc1CC2)O)C | |
Molecular propeties
| ||
| AlogP: | 5.29 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 4 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 3 | |
| Molecular Weight: | 380.2 | |
| Topological polar surface area: | 80.9 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.333 | |
| Number of carbons: | 24 | |