IUPAC Name :[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-6-methylsulfinyl-N-sulfooxyhexanimidothioate
InChI :InChI=1/C13H25NO10S3/c1-26(19)6-4-2-3-5-9(14-24-27(20,21)22)25-13-12(18)11(17)10(16)8(7-15)23-13/h8,10-13,15-18H,2-7H2,1H3,(H,20,21,22)/b14-9-/t8-,10-,11+,12-,13+,26?/m1/s1
Std.InChI: InChI=1S/C13H25NO10S3/c1-26(19)6-4-2-3-5-9(14-24-27(20,21)22)25-13-12(18)11(17)10(16)8(7-15)23-13/h8,10-13,15-18H,2-7H2,1H3,(H,20,21,22)/b14-9-/t8-,10-,11+,12-,13+,26?/m1/s1
InChIKey :HUCGRJSHMZWRQQ-PWGYDFSIBN
Std.InChIKey: HUCGRJSHMZWRQQ-PWGYDFSISA-N
SMILES :CS(=O)CCCCC/C(=N/OS(=O)(=O)O)/S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Molar Refractivity :96.15 ± 0.5 cm3 (est)
Parachor :776.6 ± 8.0 cm3 (est)
Index of Refraction :1.659 ± 0.05
(est)
Surface Tension :79.0 ± 7.0 dyne/cm (est)
Density :1.73 ± 0.1 g/cm3 (est)
Polarizability :38.12 ± 0.5 10-24cm3 (est)