apterin

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IUPAC Name :(8S,9R)-9-hydroxy-8-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-8,9-dihydrofuro[2,3-h]chromen-2-one
InChI :InChI=1/C20H24O10/c1-20(2,30-19-16(26)15(25)13(23)10(7-21)28-19)18-14(24)12-9(27-18)5-3-8-4-6-11(22)29-17(8)12/h3-6,10,13-16,18-19,21,23-26H,7H2,1-2H3/t10-,13-,14-,15+,16-,18+,19+/m1/s1
Std.InChI: InChI=1S/C20H24O10/c1-20(2,30-19-16(26)15(25)13(23)10(7-21)28-19)18-14(24)12-9(27-18)5-3-8-4-6-11(22)29-17(8)12/h3-6,10,13-16,18-19,21,23-26H,7H2,1-2H3/t10-,13-,14-,15+,16-,18+,19+/m1/s1
InChIKey :ALEQYOXVXJKFOM-KTZZUYPUBG
Std.InChIKey: ALEQYOXVXJKFOM-KTZZUYPUSA-N
SMILES :CC(C)([C@@H]1[C@@H](C2=C(O1)C=CC3=C2OC(=O)C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
Molar Refractivity :99.95 ± 0.4 cm3 (est)
Parachor :811.9 ± 6.0 cm3 (est)
Index of Refraction :1.670 ± 0.03 (est)
Surface Tension :84.9 ± 5.0 dyne/cm (est)
Density :1.58 ± 0.1 g/cm3 (est)
Polarizability :39.62 ± 0.5 10-24cm3 (est)