5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 6-O-(4-O-acetyl-6-deoxyhexopyranosyl)hexopyranoside
Chemical Structure Depiction of
5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 6-O-(4-O-acetyl-6-deoxyhexopyranosyl)hexopyranoside
5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 6-O-(4-O-acetyl-6-deoxyhexopyranosyl)hexopyranoside
Compound characteristics
| Compound ID: | N027-0007 |
| Compound Name: | 5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 6-O-(4-O-acetyl-6-deoxyhexopyranosyl)hexopyranoside |
| Molecular Weight: | 664.62 |
| Molecular Formula: | C31 H36 O16 |
| Smiles: | CC1C(C(C(C(OCC2C(C(C(C(O2)Oc2cc3c(C(C=C(c4ccc(cc4)OC)O3)=O)c(c2OC)O)O)O)O)O1)O)O)OC(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.396 |
| logD: | 1.382 |
| logSw: | -2.1314 |
| Hydrogen bond acceptors count: | 18 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 183.025 |
| InChI Key: | PXJGTASAGKWQQJ-UHFFFAOYSA-N |