IUPAC Name :[(2R,2aS,4aR,7aR,7bR)-3-formyl-2a,4a-dihydroxy-6,6,7b-trimethyl-2,5,7,7a-tetrahydro-1H-cyclobuta[e]inden-2-yl] 2,4-dihydroxy-6-methylbenzoate
InChI :InChI=1/C23H28O7/c1-12-5-14(25)6-15(26)18(12)19(27)30-17-9-21(4)16-8-20(2,3)11-22(16,28)7-13(10-24)23(17,21)29/h5-7,10,16-17,25-26,28-29H,8-9,11H2,1-4H3/t16-,17-,21-,22+,23+/m1/s1
Std.InChI: InChI=1S/C23H28O7/c1-12-5-14(25)6-15(26)18(12)19(27)30-17-9-21(4)16-8-20(2,3)11-22(16,28)7-13(10-24)23(17,21)29/h5-7,10,16-17,25-26,28-29H,8-9,11H2,1-4H3/t16-,17-,21-,22+,23+/m1/s1
InChIKey :CXDPJDYGYSRNDR-MTJRIOAFBD
Std.InChIKey: CXDPJDYGYSRNDR-MTJRIOAFSA-N
SMILES :CC1=CC(=CC(=C1C(=O)O[C@@H]2C[C@]3([C@@]2(C(=C[C@]4([C@@H]3CC(C4)(C)C)O)C=O)O)C)O)O
Molar Refractivity :107.33 ± 0.4 cm3 (est)
Parachor :858.3 ± 6.0 cm3 (est)
Index of Refraction :1.646 ± 0.03
(est)
Surface Tension :71.1 ± 5.0 dyne/cm (est)
Density :1.40 ± 0.1 g/cm3 (est)
Polarizability :42.55 ± 0.5 10-24cm3 (est)