IUPAC Name :(2E,4E,6E,8E,10E,12E,14E,16E,18E)-1-[(1R)-4-hydroxy-1,2,2-trimethylcyclopentyl]-19-(3-hydroxy-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)-4,8,13,17-tetramethylnonadeca-2,4,6,8,10,12,14,16,18-nonaen-1-one
InChI :InChI=1/C40H56O4/c1-29(17-13-19-31(3)21-22-35(43)38(9)27-33(41)25-36(38,5)6)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-24,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t33?,34?,38-,39?,40?/m0/s1
Std.InChI: InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-22-35(43)38(9)27-33(41)25-36(38,5)6)15-11-12-16-30(2)18-14-20-32(4)23-24-40-37(7,8)26-34(42)28-39(40,10)44-40/h11-24,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t33?,34?,38-,39?,40?/m0/s1
InChIKey :QAILMWKAKHIIHL-JYOOZCQFBL
Std.InChIKey: QAILMWKAKHIIHL-JYOOZCQFSA-N
SMILES :C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C12C(CC(CC1(O2)C)O)(C)C)/C=C/C=C(\C)/C=C/C(=O)[C@@]3(CC(CC3(C)C)O)C
Molar Refractivity :187.46 ± 0.3 cm3 (est)
Parachor :1454.5 ± 6.0 cm3 (est)
Index of Refraction :1.574 ± 0.02
(est)
Surface Tension :43.1 ± 3.0 dyne/cm (est)
Density :1.058 ± 0.06 g/cm3 (est)
Polarizability :74.31 ± 0.5 10-24cm3 (est)