IUPAC Name :[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-7-methylsulfinyl-N-sulfooxyheptanimidothioate
InChI :InChI=1/C14H27NO10S3/c1-27(20)7-5-3-2-4-6-10(15-25-28(21,22)23)26-14-13(19)12(18)11(17)9(8-16)24-14/h9,11-14,16-19H,2-8H2,1H3,(H,21,22,23)/b15-10+
Std.InChI: InChI=1S/C14H27NO10S3/c1-27(20)7-5-3-2-4-6-10(15-25-28(21,22)23)26-14-13(19)12(18)11(17)9(8-16)24-14/h9,11-14,16-19H,2-8H2,1H3,(H,21,22,23)/b15-10+
InChIKey :OOGAQHVYHLPICD-XNTDXEJSBE
Std.InChIKey: OOGAQHVYHLPICD-XNTDXEJSSA-N
SMILES :CS(=O)CCCCCC/C(=N\OS(=O)(=O)O)/SC1C(C(C(C(O1)CO)O)O)O
Molar Refractivity :100.76 ± 0.5 cm3 (est)
Parachor :815.2 ± 8.0 cm3 (est)
Index of Refraction :1.649 ± 0.05
(est)
Surface Tension :75.5 ± 7.0 dyne/cm (est)
Density :1.68 ± 0.1 g/cm3 (est)
Polarizability :39.94 ± 0.5 10-24cm3 (est)