(9R,10R)-9,10-Dihydroxy-8,8-Dimethyl-9,10-Dihydropyrano[2,3-F]Chromen-2-One
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL68727 | |
| PubChem: | 455821 | |
| IUPAC: | (9R,10R)-9,10-dihydroxy-8,8-dimethyl-9,10-dihydropyrano[2,3-f]chromen-2-one | |
| Standard InChI: | InChI=1S/C14H14O5/c1-14(2)13(17)11(16)10-8(19-14)5-3-7-4-6-9(15)18-12(7)10/h3-6,11,13,16-17H,1-2H3/t11-,13-/m1/s1 | |
| Standard InChI Key: | HKXQUNNSKMWIKJ-DGCLKSJQSA-N | |
| SMILES: | O=c1ccc2c(o1)c1c(cc2)OC([C@@H]([C@@H]1O)O)(C)C | |
Molecular propeties
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| AlogP: | 1.36 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 3 | |
| Molecular Weight: | 262.08 | |
| Topological polar surface area: | 76 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.357 | |
| Number of carbons: | 14 | |