cynaropicrin

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IUPAC Name :[(3aR,4S,6aR,8S,9aR,9bR)-8-hydroxy-3,6,9-trimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] 2-(hydroxymethyl)prop-2-enoate
InChI :InChI=1/C19H22O6/c1-8-5-14(24-18(22)9(2)7-20)16-11(4)19(23)25-17(16)15-10(3)13(21)6-12(8)15/h12-17,20-21H,1-7H2/t12-,13-,14-,15-,16+,17+/m0/s1
Std.InChI: InChI=1S/C19H22O6/c1-8-5-14(24-18(22)9(2)7-20)16-11(4)19(23)25-17(16)15-10(3)13(21)6-12(8)15/h12-17,20-21H,1-7H2/t12-,13-,14-,15-,16+,17+/m0/s1
InChIKey :KHSCYOFDKADJDJ-NQLMQOPMBE
Std.InChIKey: KHSCYOFDKADJDJ-NQLMQOPMSA-N
SMILES :C=C1C[C@@H]([C@@H]2[C@@H]([C@@H]3[C@H]1C[C@@H](C3=C)O)OC(=O)C2=C)OC(=O)C(=C)CO
Molar Refractivity :88.70 ± 0.4 cm3 (est)
Parachor :717.1 ± 6.0 cm3 (est)
Index of Refraction :1.571 ± 0.03 (est)
Surface Tension :49.7 ± 5.0 dyne/cm (est)
Density :1.28 ± 0.1 g/cm3 (est)
Polarizability :35.16 ± 0.5 10-24cm3 (est)