IUPAC Name :(5R,5aR,8aR,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one
InChI :InChI=1/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1
Std.InChI: InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1
InChIKey :YJGVMLPVUAXIQN-XVVDYKMHBO
Std.InChIKey: YJGVMLPVUAXIQN-XVVDYKMHSA-N
SMILES :COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)O
MDL: MFCD00075290
Molar Refractivity :104.28 ± 0.3 cm3 (est)
Parachor :815.0 ± 6.0 cm3 (est)
Index of Refraction :1.605 ± 0.02 (est)
Surface Tension :52.7 ± 3.0 dyne/cm (est)
Density :1.370 ± 0.06 g/cm3 (est)
Polarizability :41.34 ± 0.5 10-24cm3 (est)