IUPAC Name :3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoic acid
InChI :InChI=1/C25H24O13/c1-34-13-6-14-20(30)15(11-2-4-12(26)5-3-11)9-36-24(14)16(7-13)37-25-23(33)22(32)21(31)17(38-25)10-35-19(29)8-18(27)28/h2-7,9,17,21-23,25-26,31-33H,8,10H2,1H3,(H,27,28)/t17-,21-,22+,23-,25-/m1/s1
Std.InChI: InChI=1S/C25H24O13/c1-34-13-6-14-20(30)15(11-2-4-12(26)5-3-11)9-36-24(14)16(7-13)37-25-23(33)22(32)21(31)17(38-25)10-35-19(29)8-18(27)28/h2-7,9,17,21-23,25-26,31-33H,8,10H2,1H3,(H,27,28)/t17-,21-,22+,23-,25-/m1/s1
InChIKey :OYDNPVAEDDPNLO-XIRKIXBGBV
Std.InChIKey: OYDNPVAEDDPNLO-XIRKIXBGSA-N
SMILES :COc1cc2c(=O)c(coc2c(c1)OC3C(C(C(C(O3)COC(=O)CC(=O)O)O)O)O)c4ccc(cc4)O
MDL: MFCD02684046
Molar Refractivity :124.17 ± 0.3 cm3 (est)
Parachor :1008.1 ± 6.0 cm3 (est)
Index of Refraction :1.653 ± 0.02
(est)
Surface Tension :78.3 ± 3.0 dyne/cm (est)
Density :1.571 ± 0.06 g/cm3 (est)
Polarizability :49.22 ± 0.5 10-24cm3 (est)