IUPAC Name :O-ethyl N-[[4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenyl]methyl]carbamothioate
InChI :InChI=1/C16H23NO6S/c1-3-21-16(24)17-8-10-4-6-11(7-5-10)23-15-14(20)13(19)12(18)9(2)22-15/h4-7,9,12-15,18-20H,3,8H2,1-2H3,(H,17,24)/t9-,12-,13+,14+,15-/m0/s1
Std.InChI: InChI=1S/C16H23NO6S/c1-3-21-16(24)17-8-10-4-6-11(7-5-10)23-15-14(20)13(19)12(18)9(2)22-15/h4-7,9,12-15,18-20H,3,8H2,1-2H3,(H,17,24)/t9-,12-,13+,14+,15-/m0/s1
InChIKey :JOSHUAQJVMGTGS-NBUQLFNLBD
Std.InChIKey: JOSHUAQJVMGTGS-NBUQLFNLSA-N
SMILES :CCOC(=S)NCC1=CC=C(C=C1)O[C@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)C)O)O)O
Molar Refractivity :87.91 ± 0.5 cm3 (est)
Parachor :670.5 ± 8.0 cm3 (est)
Index of Refraction :1.602 ± 0.05
(est)
Surface Tension :46.9 ± 7.0 dyne/cm (est)
Density :1.39 ± 0.1 g/cm3 (est)
Polarizability :34.85 ± 0.5 10-24cm3 (est)