IUPAC Name :2-amino-6-[(1S,2R)-1,2,3-trihydroxypropyl]-1H-pteridin-4-one
InChI :InChI=1/C9H11N5O4/c10-9-13-7-5(8(18)14-9)12-3(1-11-7)6(17)4(16)2-15/h1,4,6,15-17H,2H2,(H3,10,11,13,14,18)/t4-,6+/m1/s1
Std.InChI: InChI=1S/C9H11N5O4/c10-9-13-7-5(8(18)14-9)12-3(1-11-7)6(17)4(16)2-15/h1,4,6,15-17H,2H2,(H3,10,11,13,14,18)/t4-,6+/m1/s1
InChIKey :BMQYVXCPAOLZOK-XINAWCOVBJ
Std.InChIKey: BMQYVXCPAOLZOK-XINAWCOVSA-N
SMILES :C1=C(N=C2C(=N1)NC(=NC2=O)N)[C@@H]([C@@H](CO)O)O
MDL: MFCD00042801
Molar Refractivity :56.46 ± 0.5 cm3 (est)
Parachor :401.1 ± 8.0 cm3 (est)
Index of Refraction :1.860 ± 0.05
(est)
Surface Tension :105.0 ± 7.0 dyne/cm (est)
Density :2.02 ± 0.1 g/cm3 (est)
Polarizability :22.38 ± 0.5 10-24cm3 (est)