Gancaonin P
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL463452 | |
| PubChem: | 5481966 | |
| IUPAC: | 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-(3-methylbut-2-enyl)chromen-4-one | |
| Standard InChI: | InChI=1S/C20H18O7/c1-9(2)3-5-11-13(22)8-15-16(17(11)24)18(25)19(26)20(27-15)10-4-6-12(21)14(23)7-10/h3-4,6-8,21-24,26H,5H2,1-2H3 | |
| Standard InChI Key: | OCIIFJFJVOTFTN-UHFFFAOYSA-N | |
| SMILES: | CC(=CCc1c(O)cc2c(c1O)c(=O)c(c(o2)c1ccc(c(c1)O)O)O)C | |
Molecular propeties
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| AlogP: | 3.5 | |
|---|---|---|
| Hydrogen bonds acceptors: | 7 | |
| Hydrogen bonds donors: | 5 | |
| Rotatable bonds: | 3 | |
| Number of rings: | 3 | |
| Molecular Weight: | 370.11 | |
| Topological polar surface area: | 127 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.15 | |
| Number of carbons: | 20 | |