IUPAC Name :(2S,3S,4S,5R,6S)-6-(4-acetamidophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI :InChI=1/C14H17NO8/c1-6(16)15-7-2-4-8(5-3-7)22-14-11(19)9(17)10(18)12(23-14)13(20)21/h2-5,9-12,14,17-19H,1H3,(H,15,16)(H,20,21)/t9-,10-,11+,12-,14+/m0/s1
Std.InChI: InChI=1S/C14H17NO8/c1-6(16)15-7-2-4-8(5-3-7)22-14-11(19)9(17)10(18)12(23-14)13(20)21/h2-5,9-12,14,17-19H,1H3,(H,15,16)(H,20,21)/t9-,10-,11+,12-,14+/m0/s1
InChIKey :IPROLSVTVHAQLE-BYNIDDHOBJ
Std.InChIKey: IPROLSVTVHAQLE-BYNIDDHOSA-N
SMILES :CC(=O)NC1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O
MDL: MFCD03094680
Molar Refractivity :72.72 ± 0.5 cm3 (est)
Parachor :569.8 ± 8.0 cm3 (est)
Index of Refraction :1.641 ± 0.05
(est)
Surface Tension :63.9 ± 7.0 dyne/cm (est)
Density :1.62 ± 0.1 g/cm3 (est)
Polarizability :28.83 ± 0.5 10-24cm3 (est)