sonchuside A

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IUPAC Name :(3S,3aR,6E,9S,10E,11aS)-3,6,10-trimethyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,8,9,11a-hexahydro-3H-cyclodeca[b]furan-2-one
InChI :InChI=1/C21H32O8/c1-10-4-6-13-12(3)20(26)27-15(13)8-11(2)14(7-5-10)28-21-19(25)18(24)17(23)16(9-22)29-21/h5,8,12-19,21-25H,4,6-7,9H2,1-3H3/b10-5+,11-8+/t12-,13+,14-,15+,16+,17+,18-,19+,21+/m0/s1
Std.InChI: InChI=1S/C21H32O8/c1-10-4-6-13-12(3)20(26)27-15(13)8-11(2)14(7-5-10)28-21-19(25)18(24)17(23)16(9-22)29-21/h5,8,12-19,21-25H,4,6-7,9H2,1-3H3/b10-5+,11-8+/t12-,13+,14-,15+,16+,17+,18-,19+,21+/m0/s1
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InChIKey :OWPORVMZZJAHEF-BJCRYQPIBK
Std.InChIKey: OWPORVMZZJAHEF-BJCRYQPISA-N
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SMILES :C[C@H]1[C@H]2CC/C(=C/C[C@@H](/C(=C/[C@H]2OC1=O)/C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)/C
Molar Refractivity :103.80 ± 0.4 cm3 (est)
Parachor :866.4 ± 6.0 cm3 (est)
Index of Refraction :1.575 ± 0.03 (est)
Surface Tension :58.1 ± 5.0 dyne/cm (est)
Density :1.31 ± 0.1 g/cm3 (est)
Polarizability :41.14 ± 0.5 10-24cm3 (est)