IUPAC Name :[(2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl](E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
InChI :InChI=1/C29H36O15/c1-13-22(36)23(37)24(38)29(41-13)44-27-25(39)28(40-9-8-15-3-6-17(32)19(34)11-15)42-20(12-30)26(27)43-21(35)7-4-14-2-5-16(31)18(33)10-14/h2-7,10-11,13,20,22-34,36-39H,8-9,12H2,1H3/b7-4+/t13-,20+,22-,23+,24+,25+,26+,27+,28+,29-/m0/s1
Std.InChI: InChI=1S/C29H36O15/c1-13-22(36)23(37)24(38)29(41-13)44-27-25(39)28(40-9-8-15-3-6-17(32)19(34)11-15)42-20(12-30)26(27)43-21(35)7-4-14-2-5-16(31)18(33)10-14/h2-7,10-11,13,20,22-34,36-39H,8-9,12H2,1H3/b7-4+/t13-,20+,22-,23+,24+,25+,26+,27+,28+,29-/m0/s1
InChIKey :FBSKJMQYURKNSU-ZLSOWSIRBQ
Std.InChIKey: FBSKJMQYURKNSU-ZLSOWSIRSA-N
SMILES :O=C(O[C@H]3[C@H](O[C@@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C)[C@@H](O)[C@H](OCCc2ccc(O)c(O)c2)O[C@@H]3CO)\C=C\c4ccc(O)c(O)c4
MDL: MFCD00221751
Molar Refractivity :148.40 ± 0.4 cm3 (est)
Parachor :1219.7 ± 6.0 cm3 (est)
Index of Refraction :1.689 ± 0.03
(est)
Surface Tension :97.0 ± 5.0 dyne/cm (est)
Density :1.60 ± 0.1 g/cm3 (est)
Polarizability :58.83 ± 0.5 10-24cm3 (est)