IUPAC Name :[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-2-(1H-indol-3-yl)-N-sulfooxyethanimidothioate
InChI :InChI=1/C16H20N2O9S2/c19-7-11-13(20)14(21)15(22)16(26-11)28-12(18-27-29(23,24)25)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-17,19-22H,5,7H2,(H,23,24,25)/b18-12-/t11-,13-,14+,15-,16+/m1/s1
Std.InChI: InChI=1S/C16H20N2O9S2/c19-7-11-13(20)14(21)15(22)16(26-11)28-12(18-27-29(23,24)25)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-17,19-22H,5,7H2,(H,23,24,25)/b18-12-/t11-,13-,14+,15-,16+/m1/s1
InChIKey :DNDNWOWHUWNBCK-PIAXYHQTBF
Std.InChIKey: DNDNWOWHUWNBCK-PIAXYHQTSA-N
SMILES :C1=CC=C2C(=C1)C(=CN2)C/C(=N/OS(=O)(=O)O)/S[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
Molar Refractivity :99.34 ± 0.5 cm3 (est)
Parachor :744.5 ± 8.0 cm3 (est)
Index of Refraction :1.733 ± 0.05
(est)
Surface Tension :81.1 ± 7.0 dyne/cm (est)
Density :1.80 ± 0.1 g/cm3 (est)
Polarizability :39.38 ± 0.5 10-24cm3 (est)