kericembrenolide A

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IUPAC Name :[(3aR,6Z,10Z,12S,14Z,15aS)-6,10,14-trimethyl-3-methylidene-2-oxo-3a,4,5,8,9,12,13,15a-octahydrocyclotetradeca[b]furan-12-yl] acetate
InChI :InChI=1/C22H30O4/c1-14-7-6-8-15(2)11-19(25-18(5)23)12-16(3)13-21-20(10-9-14)17(4)22(24)26-21/h7,11,13,19-21H,4,6,8-10,12H2,1-3,5H3/b14-7-,15-11-,16-13-/t19-,20-,21+/m1/s1
Std.InChI: InChI=1S/C22H30O4/c1-14-7-6-8-15(2)11-19(25-18(5)23)12-16(3)13-21-20(10-9-14)17(4)22(24)26-21/h7,11,13,19-21H,4,6,8-10,12H2,1-3,5H3/b14-7-,15-11-,16-13-/t19-,20-,21+/m1/s1
InChIKey :QPGQFHSQSJTROZ-ZRGOFDNFBN
Std.InChIKey: QPGQFHSQSJTROZ-ZRGOFDNFSA-N
SMILES :C/C/1=C/CC/C(=C\[C@H](C/C(=C\[C@H]2[C@H](CC1)C(=C)C(=O)O2)/C)OC(=O)C)/C
Molar Refractivity :102.06 ± 0.4 cm3 (est)
Parachor :834.2 ± 6.0 cm3 (est)
Index of Refraction :1.521 ± 0.03 (est)
Surface Tension :38.5 ± 5.0 dyne/cm (est)
Density :1.07 ± 0.1 g/cm3 (est)
Polarizability :40.46 ± 0.5 10-24cm3 (est)