IUPAC Name :[(3aR,4S,6R,6aR,9aR,9bR)-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[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/h5,11-15,20H,2,6-7H2,1,3-4H3/t11-,12+,13+,14-,15-,17-/m1/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/h5,11-15,20H,2,6-7H2,1,3-4H3/t11-,12+,13+,14-,15-,17-/m1/s1
InChIKey :XMJROHDIQQOWTO-NRPXGKOBBH
Std.InChIKey: XMJROHDIQQOWTO-NRPXGKOBSA-N
SMILES :CC1=CC[C@@H]2[C@H]1[C@@H]3[C@@H]([C@H](C[C@@]2(C)O)OC(=O)C)C(=C)C(=O)O3
Molar Refractivity :79.00 ± 0.4 cm3 (est)
Parachor :645.9 ± 6.0 cm3 (est)
Index of Refraction :1.550 ± 0.03
(est)
Surface Tension :46.1 ± 5.0 dyne/cm (est)
Density :1.23 ± 0.1 g/cm3 (est)
Polarizability :31.31 ± 0.5 10-24cm3 (est)