IUPAC Name :(E)-6-(3-acetyloxy-15-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylhept-2-enoic acid
InChI :InChI=1/C32H48O5/c1-19(10-9-11-20(2)28(35)36)24-18-26(34)32(8)23-12-13-25-29(4,5)27(37-21(3)33)15-16-30(25,6)22(23)14-17-31(24,32)7/h11-12,14,19,24-27,34H,9-10,13,15-18H2,1-8H3,(H,35,36)/b20-11+
Std.InChI: InChI=1S/C32H48O5/c1-19(10-9-11-20(2)28(35)36)24-18-26(34)32(8)23-12-13-25-29(4,5)27(37-21(3)33)15-16-30(25,6)22(23)14-17-31(24,32)7/h11-12,14,19,24-27,34H,9-10,13,15-18H2,1-8H3,(H,35,36)/b20-11+
InChIKey :NXZJPJLQVAKBTH-RGVLZGJSBO
Std.InChIKey: NXZJPJLQVAKBTH-RGVLZGJSSA-N
SMILES :CC(CC/C=C(\C)/C(=O)O)C1CC(C2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C)O
Molar Refractivity :146.05 ± 0.4 cm3 (est)
Parachor :1185.3 ± 6.0 cm3 (est)
Index of Refraction :1.555 ± 0.03
(est)
Surface Tension :46.1 ± 5.0 dyne/cm (est)
Density :1.12 ± 0.1 g/cm3 (est)
Polarizability :57.90 ± 0.5 10-24cm3 (est)