Erythro-Guaiacylglycerol
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL3608841 | |
| PubChem: | 12310250 | |
| IUPAC: | (1S,2R)-1-(4-hydroxy-3-methoxyphenyl)propane-1,2,3-triol | |
| Standard InChI: | InChI=1S/C10H14O5/c1-15-9-4-6(2-3-7(9)12)10(14)8(13)5-11/h2-4,8,10-14H,5H2,1H3/t8-,10+/m1/s1 | |
| Standard InChI Key: | LSKFUSLVUZISST-SCZZXKLOSA-N | |
| SMILES: | OC[C@H]([C@H](c1ccc(c(c1)OC)O)O)O | |
Molecular propeties
| ||
| AlogP: | -0.21 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 4 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 1 | |
| Molecular Weight: | 214.08 | |
| Topological polar surface area: | 90.2 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.4 | |
| Number of carbons: | 10 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
|---|