4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl 2,3,4,6-tetra-O-acetylhexopyranoside
Chemical Structure Depiction of
4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl 2,3,4,6-tetra-O-acetylhexopyranoside
4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl 2,3,4,6-tetra-O-acetylhexopyranoside
Compound characteristics
Compound ID: | Y040-7939 |
Compound Name: | 4-ethyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl 2,3,4,6-tetra-O-acetylhexopyranoside |
Molecular Weight: | 534.52 |
Molecular Formula: | C26 H30 O12 |
Smiles: | CCC1=CC(=O)Oc2c1ccc(c2C)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O1)OC(C)=O)OC(C)=O)OC(C)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.8667 |
logD: | 2.8667 |
logSw: | -3.2419 |
Hydrogen bond acceptors count: | 17 |
Polar surface area: | 118.315 |
InChI Key: | DRTWYOMLVCKCMG-SSKCBDBQSA-N |