sorgolactone

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IUPAC Name :(3E,3aR,8S,8bS)-8-methyl-3-[[(2R)-4-methyl-5-oxo-2H-furan-2-yl]oxymethylidene]-4,5,6,7,8,8b-hexahydro-3aH-indeno[1,2-b]furan-2-one
InChI :InChI=1/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9-,12+,14+,16-/m0/s1
Std.InChI: InChI=1S/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9-,12+,14+,16-/m0/s1
InChIKey :KHSREFIWULNDAB-YCUBLIQYBH
Std.InChIKey: KHSREFIWULNDAB-YCUBLIQYSA-N
SMILES :C[C@H]1CCCC2=C1[C@@H]3[C@H](C2)/C(=C\O[C@H]4C=C(C(=O)O4)C)/C(=O)O3
Molar Refractivity :81.40 ± 0.4 cm3 (est)
Parachor :644.1 ± 6.0 cm3 (est)
Index of Refraction :1.581 ± 0.03 (est)
Surface Tension :48.6 ± 5.0 dyne/cm (est)
Density :1.29 ± 0.1 g/cm3 (est)
Polarizability :32.27 ± 0.5 10-24cm3 (est)