IUPAC Name :[(3S,8R,9S,10R,13R,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
InChI :InChI=1/C38H56O4/c1-24(2)25(3)8-9-26(4)31-14-15-32-30-13-12-28-23-29(18-20-37(28,5)33(30)19-21-38(31,32)6)42-36(40)17-11-27-10-16-34(39)35(22-27)41-7/h10-12,16-17,22,24-26,29-33,39H,8-9,13-15,18-21,23H2,1-7H3/t25-,26-,29+,30-,31-,32+,33+,37+,38-/m1/s1
Std.InChI: InChI=1S/C38H56O4/c1-24(2)25(3)8-9-26(4)31-14-15-32-30-13-12-28-23-29(18-20-37(28,5)33(30)19-21-38(31,32)6)42-36(40)17-11-27-10-16-34(39)35(22-27)41-7/h10-12,16-17,22,24-26,29-33,39H,8-9,13-15,18-21,23H2,1-7H3/t25-,26-,29+,30-,31-,32+,33+,37+,38-/m1/s1
InChIKey :SWIWTAJTJOYCTB-PTTCRRSGBN
Std.InChIKey: SWIWTAJTJOYCTB-PTTCRRSGSA-N
SMILES :C[C@H](CC[C@@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C=CC5=CC(=C(C=C5)O)OC)C)C
Molar Refractivity :171.31 ± 0.4 cm3 (est)
Parachor :1374.9 ± 6.0 cm3 (est)
Index of Refraction :1.557 ± 0.03
(est)
Surface Tension :44.6 ± 5.0 dyne/cm (est)
Density :1.08 ± 0.1 g/cm3 (est)
Polarizability :67.91 ± 0.5 10-24cm3 (est)