IUPAC Name :(E)-4-[(1R,2S,4S)-1,2-dihydroxy-2,6,6-trimethyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]but-3-en-2-one
InChI :InChI=1/C19H32O9/c1-10(21)5-6-19(26)17(2,3)7-11(8-18(19,4)25)27-16-15(24)14(23)13(22)12(9-20)28-16/h5-6,11-16,20,22-26H,7-9H2,1-4H3/b6-5+/t11-,12+,13+,14-,15+,16+,18-,19+/m0/s1
Std.InChI: InChI=1S/C19H32O9/c1-10(21)5-6-19(26)17(2,3)7-11(8-18(19,4)25)27-16-15(24)14(23)13(22)12(9-20)28-16/h5-6,11-16,20,22-26H,7-9H2,1-4H3/b6-5+/t11-,12+,13+,14-,15+,16+,18-,19+/m0/s1
InChIKey :PASRVRCWYGWSDQ-FBOCVPDYBO
Std.InChIKey: PASRVRCWYGWSDQ-FBOCVPDYSA-N
SMILES :CC(=O)/C=C/[C@@]1([C@@](C[C@H](CC1(C)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)(C)O)O
Molar Refractivity :98.54 ± 0.4 cm3 (est)
Parachor :844.2 ± 6.0 cm3 (est)
Index of Refraction :1.582 ± 0.03
(est)
Surface Tension :66.9 ± 5.0 dyne/cm (est)
Density :1.37 ± 0.1 g/cm3 (est)
Polarizability :39.06 ± 0.5 10-24cm3 (est)