IUPAC Name :[(3R,3aS,4S,8aR)-3-hydroxy-6,8a-dimethyl-3-propan-2-yl-1,2,3a,4,5,8-hexahydroazulen-4-yl] 4-hydroxybenzoate
InChI :InChI=1/C22H30O4/c1-14(2)22(25)12-11-21(4)10-9-15(3)13-18(19(21)22)26-20(24)16-5-7-17(23)8-6-16/h5-9,14,18-19,23,25H,10-13H2,1-4H3/t18-,19+,21-,22+/m0/s1
Std.InChI: InChI=1S/C22H30O4/c1-14(2)22(25)12-11-21(4)10-9-15(3)13-18(19(21)22)26-20(24)16-5-7-17(23)8-6-16/h5-9,14,18-19,23,25H,10-13H2,1-4H3/t18-,19+,21-,22+/m0/s1
InChIKey :CYSHNJQMYORNJI-YUVXSKOABU
Std.InChIKey: CYSHNJQMYORNJI-YUVXSKOASA-N
SMILES :CC1=CC[C@]2(CC[C@]([C@@H]2[C@H](C1)OC(=O)C3=CC=C(C=C3)O)(C(C)C)O)C
MDL: MFCD00274479
Molar Refractivity :101.30 ± 0.4 cm3 (est)
Parachor :813.8 ± 6.0 cm3 (est)
Index of Refraction :1.573 ± 0.03
(est)
Surface Tension :49.1 ± 5.0 dyne/cm (est)
Density :1.16 ± 0.1 g/cm3 (est)
Polarizability :40.16 ± 0.5 10-24cm3 (est)