(-)-Larreatricin
Representations & DB's id
| ||
| ChEBI: | CHEBI:69246 | |
|---|---|---|
| ChEMBL: | CHEMBL2147416 | |
| PubChem: | 26389403 | |
| IUPAC: | 4-[(2S,3S,4R,5S)-5-(4-hydroxyphenyl)-3,4-dimethyloxolan-2-yl]phenol | |
| Standard InChI: | InChI=1S/C18H20O3/c1-11-12(2)18(14-5-9-16(20)10-6-14)21-17(11)13-3-7-15(19)8-4-13/h3-12,17-20H,1-2H3/t11-,12+,17-,18-/m0/s1 | |
| Standard InChI Key: | PIBJADPEZQHMQS-CMKMFDCUSA-N | |
| SMILES: | C[C@@H]1[C@H](O[C@@H]([C@@H]1C)c1ccc(cc1)O)c1ccc(cc1)O | |
Molecular propeties
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| AlogP: | 4.18 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 3 | |
| Molecular Weight: | 284.14 | |
| Topological polar surface area: | 49.7 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.333 | |
| Number of carbons: | 18 | |