Hexahydrocurcumin
Representations & DB's id
| ||
| ChEBI: | CHEBI:81358 | |
|---|---|---|
| ChEMBL: | CHEMBL479650 | |
| PubChem: | 5318039 | |
| IUPAC: | 5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptan-3-one | |
| Standard InChI: | InChI=1S/C21H26O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h5-6,9-12,16,22,24-25H,3-4,7-8,13H2,1-2H3 | |
| Standard InChI Key: | RSAHICAPUYTWHW-UHFFFAOYSA-N | |
| SMILES: | COc1cc(CCC(CC(=O)CCc2ccc(c(c2)OC)O)O)ccc1O | |
Molecular propeties
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| AlogP: | 3 | |
|---|---|---|
| Hydrogen bonds acceptors: | 6 | |
| Hydrogen bonds donors: | 3 | |
| Rotatable bonds: | 10 | |
| Number of rings: | 2 | |
| Molecular Weight: | 374.17 | |
| Topological polar surface area: | 96.2 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.381 | |
| Number of carbons: | 21 | |