IUPAC Name :(2R,3R)-3,5,7-trihydroxy-2-[(2R,3S)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrochromen-4-one
InChI :InChI=1/C25H22O10/c1-33-18-6-10(2-3-15(18)28)23-14(9-26)13-4-11(5-17(30)25(13)35-23)24-22(32)21(31)20-16(29)7-12(27)8-19(20)34-24/h2-8,14,22-24,26-30,32H,9H2,1H3/t14-,22+,23+,24-/m1/s1
Std.InChI: InChI=1S/C25H22O10/c1-33-18-6-10(2-3-15(18)28)23-14(9-26)13-4-11(5-17(30)25(13)35-23)24-22(32)21(31)20-16(29)7-12(27)8-19(20)34-24/h2-8,14,22-24,26-30,32H,9H2,1H3/t14-,22+,23+,24-/m1/s1
InChIKey :BMLIIPOXVWESJG-LMBCONBSBS
Std.InChIKey: BMLIIPOXVWESJG-LMBCONBSSA-N
SMILES :COC1=C(C=CC(=C1)[C@H]2[C@@H](C3=C(O2)C(=CC(=C3)[C@@H]4[C@H](C(=O)C5=C(C=C(C=C5O4)O)O)O)O)CO)O
MDL: MFCD00883715
Molar Refractivity :120.24 ± 0.3 cm3 (est)
Parachor :918.5 ± 6.0 cm3 (est)
Index of Refraction :1.716 ± 0.02
(est)
Surface Tension :81.6 ± 3.0 dyne/cm (est)
Density :1.578 ± 0.06 g/cm3 (est)
Polarizability :47.66 ± 0.5 10-24cm3 (est)