achillicin

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IUPAC Name :[(3S,3aR,4S,6R,9bS)-6-hydroxy-3,6,9-trimethyl-2-oxo-3,3a,4,5,8,9b-hexahydroazuleno[4,5-b]furan-4-yl] acetate
InChI :InChI=1/C17H22O5/c1-8-5-6-11-13(8)15-14(9(2)16(19)22-15)12(21-10(3)18)7-17(11,4)20/h6,9,12,14-15,20H,5,7H2,1-4H3/t9-,12-,14+,15+,17+/m0/s1
Std.InChI: InChI=1S/C17H22O5/c1-8-5-6-11-13(8)15-14(9(2)16(19)22-15)12(21-10(3)18)7-17(11,4)20/h6,9,12,14-15,20H,5,7H2,1-4H3/t9-,12-,14+,15+,17+/m0/s1
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InChIKey :ZPTLTKQKVWFFNY-SZQAVTOOBS
Std.InChIKey: ZPTLTKQKVWFFNY-SZQAVTOOSA-N
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SMILES :C[C@H]1[C@@H]2[C@H](C[C@@](C3=CCC(=C3[C@H]2OC1=O)C)(C)O)OC(=O)C
Molar Refractivity :78.93 ± 0.4 cm3 (est)
Parachor :642.6 ± 6.0 cm3 (est)
Index of Refraction :1.557 ± 0.03 (est)
Surface Tension :47.3 ± 5.0 dyne/cm (est)
Density :1.25 ± 0.1 g/cm3 (est)
Polarizability :31.29 ± 0.5 10-24cm3 (est)