IUPAC Name :(3S,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
InChI :InChI=1/C21H24O7/c1-25-17-8-12(4-5-16(17)22)6-14-11-28-21(24)15(14)7-13-9-18(26-2)20(23)19(10-13)27-3/h4-5,8-10,14-15,22-23H,6-7,11H2,1-3H3/t14-,15+/m1/s1
Std.InChI: InChI=1S/C21H24O7/c1-25-17-8-12(4-5-16(17)22)6-14-11-28-21(24)15(14)7-13-9-18(26-2)20(23)19(10-13)27-3/h4-5,8-10,14-15,22-23H,6-7,11H2,1-3H3/t14-,15+/m1/s1
InChIKey :XMLWGUKRPGLJGA-CABCVRREBA
Std.InChIKey: XMLWGUKRPGLJGA-CABCVRRESA-N
SMILES :COC1=CC(=CC(=C1O)OC)C[C@H]2[C@@H](COC2=O)CC3=CC(=C(C=C3)O)OC
Molar Refractivity :102.31 ± 0.3 cm3 (est)
Parachor :816.1 ± 6.0 cm3 (est)
Index of Refraction :1.593 ± 0.02
(est)
Surface Tension :53.5 ± 3.0 dyne/cm (est)
Density :1.287 ± 0.06 g/cm3 (est)
Polarizability :40.56 ± 0.5 10-24cm3 (est)