IUPAC Name :methyl (1S,2R,4R,5R,6R,7R,8R,11R)-4,5,7,11-tetrahydroxy-2-methyl-2',10-dioxospiro[9-oxatricyclo[6.3.1.01,5]dodecane-6,3'-oxetane]-7-carboxylate
InChI :InChI=1/C16H20O10/c1-6-3-7(17)16(23)13(6)4-8(26-10(19)9(13)18)15(22,12(21)24-2)14(16)5-25-11(14)20/h6-9,17-18,22-23H,3-5H2,1-2H3/t6-,7-,8-,9+,13+,14+,15-,16-/m1/s1
Std.InChI: InChI=1S/C16H20O10/c1-6-3-7(17)16(23)13(6)4-8(26-10(19)9(13)18)15(22,12(21)24-2)14(16)5-25-11(14)20/h6-9,17-18,22-23H,3-5H2,1-2H3/t6-,7-,8-,9+,13+,14+,15-,16-/m1/s1
InChIKey :JTVRXANWSWLMEV-SGRUWRQSBQ
Std.InChIKey: JTVRXANWSWLMEV-SGRUWRQSSA-N
SMILES :C[C@@H]1C[C@H]([C@]2([C@@]13C[C@H]([C@]([C@@]24COC4=O)(C(=O)OC)O)OC(=O)[C@@H]3O)O)O
Molar Refractivity :79.61 ± 0.4 cm3 (est)
Parachor :674.5 ± 6.0 cm3 (est)
Index of Refraction :1.643 ± 0.03
(est)
Surface Tension :88.2 ± 5.0 dyne/cm (est)
Density :1.69 ± 0.1 g/cm3 (est)
Polarizability :31.56 ± 0.5 10-24cm3 (est)