IUPAC Name :[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-[(1-hydroxy-6-oxocyclohex-2-ene-1-carbonyl)oxymethyl]phenoxy]oxan-3-yl] benzoate
InChI :InChI=1/C27H28O11/c28-14-19-21(30)22(31)23(38-24(32)16-8-2-1-3-9-16)25(37-19)36-18-11-5-4-10-17(18)15-35-26(33)27(34)13-7-6-12-20(27)29/h1-5,7-11,13,19,21-23,25,28,30-31,34H,6,12,14-15H2/t19-,21-,22+,23-,25-,27?/m1/s1
Std.InChI: InChI=1S/C27H28O11/c28-14-19-21(30)22(31)23(38-24(32)16-8-2-1-3-9-16)25(37-19)36-18-11-5-4-10-17(18)15-35-26(33)27(34)13-7-6-12-20(27)29/h1-5,7-11,13,19,21-23,25,28,30-31,34H,6,12,14-15H2/t19-,21-,22+,23-,25-,27?/m1/s1
InChIKey :RCKCYCDBDYUIGM-LFMHJWGUBO
Std.InChIKey: RCKCYCDBDYUIGM-LFMHJWGUSA-N
SMILES :C1CC(=O)C(C=C1)(C(=O)OCC2=CC=CC=C2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)OC(=O)C4=CC=CC=C4)O
MDL: MFCD00238697
Molar Refractivity :130.09 ± 0.4 cm3 (est)
Parachor :1056.3 ± 6.0 cm3 (est)
Index of Refraction :1.649 ± 0.03
(est)
Surface Tension :76.8 ± 5.0 dyne/cm (est)
Density :1.48 ± 0.1 g/cm3 (est)
Polarizability :51.57 ± 0.5 10-24cm3 (est)