Longistyline D
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL471086 | |
| PubChem: | 18546463 | |
| IUPAC: | 4,6-bis(3-methylbut-2-enyl)-5-[(E)-2-phenylethenyl]benzene-1,3-diol | |
| Standard InChI: | InChI=1S/C24H28O2/c1-17(2)10-13-21-20(15-12-19-8-6-5-7-9-19)22(14-11-18(3)4)24(26)16-23(21)25/h5-12,15-16,25-26H,13-14H2,1-4H3/b15-12+ | |
| Standard InChI Key: | OKMVXSASFNVYOK-NTCAYCPXSA-N | |
| SMILES: | CC(=CCc1c(O)cc(c(c1/C=C/c1ccccc1)CC=C(C)C)O)C | |
Molecular propeties
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| AlogP: | 6.29 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 6 | |
| Number of rings: | 2 | |
| Molecular Weight: | 348.21 | |
| Topological polar surface area: | 40.5 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.25 | |
| Number of carbons: | 24 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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