(7R)-7-Hydroxylariciresinol
Representations & DB's id
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| ChEBI: | CHEBI:70195 | |
|---|---|---|
| ChEMBL: | CHEMBL1668112 | |
| PubChem: | 10022393 | |
| IUPAC: | 4-[(2S,3R,4R)-4-[(R)-hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenol | |
| Standard InChI: | InChI=1S/C20H24O7/c1-25-17-7-11(3-5-15(17)22)19(24)14-10-27-20(13(14)9-21)12-4-6-16(23)18(8-12)26-2/h3-8,13-14,19-24H,9-10H2,1-2H3/t13-,14-,19-,20+/m0/s1 | |
| Standard InChI Key: | MWQRAOGWLXTMIC-WZBLMQSHSA-N | |
| SMILES: | OC[C@@H]1[C@H](OC[C@@H]1[C@H](c1ccc(c(c1)OC)O)O)c1ccc(c(c1)OC)O | |
Molecular propeties
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| AlogP: | 2.14 | |
|---|---|---|
| Hydrogen bonds acceptors: | 7 | |
| Hydrogen bonds donors: | 4 | |
| Rotatable bonds: | 6 | |
| Number of rings: | 3 | |
| Molecular Weight: | 376.15 | |
| Topological polar surface area: | 109 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.4 | |
| Number of carbons: | 20 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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