2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl hexopyranoside
Chemical Structure Depiction of
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl hexopyranoside
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl hexopyranoside
Compound characteristics
| Compound ID: | 0407-0014 |
| Compound Name: | 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl hexopyranoside |
| Molecular Weight: | 464.38 |
| Molecular Formula: | C21 H20 O12 |
| Smiles: | [H]C1(C([H])(C([H])(CO)OC([H])(C1([H])O)OC1=C(c2ccc(c(c2)O)O)Oc2cc(cc(c2C1=O)O)O)O)O |
| Stereo: | ABSOLUTE |
| logP: | -0.5164 |
| logD: | -1.647 |
| logSw: | -1.9179 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 8 |
| Polar surface area: | 167.715 |
| InChI Key: | OVSQVDMCBVZWGM-UHFFFAOYSA-N |