Cholesteryl stearate

The Cholesteryl stearate, with CAS registry number 35602-69-8, belongs to the following product categories: (1)Cholesteryl Compounds (Liquid Crystals); (2)Functional Materials; (3)Liquid Crystals & Related Compounds; (4)Steroids. It has the systematic name of (3β)-cholest-5-en-3-yl octadecanoate. This chemical should be stored at the temperature of -20°C. When use this chemical, avoid contact with skin and eyes. 

Physical properties of Cholesteryl stearate: (1)ACD/LogP: 19.21; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 19.21; (4)ACD/LogD (pH 7.4): 19.21; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 23; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.505; (14)Molar Refractivity: 203.65 cm³; (15)Molar Volume: 686.2 cm³; (16)Polarizability: 80.73×10^-24cm³; (17)Surface Tension: 37.9 dyne/cm; (18)Density: 0.95 g/cm³; (19)Flash Point: 360.6 °C; (20)Enthalpy of Vaporization: 98.69 kJ/mol; (21)Boiling Point: 671.7 °C at 760 mmHg; (22)Vapour Pressure: 6.6E-18 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O[C@@H]4C/C3=C/C[C@@H]1[C@H](CC[C@]2([C@H]1CC[C@@H]2[C@H](C)CCCC(C)C)C)[C@@]3(C)CC4)CCCCCCCCCCCCCCCCC
(2)InChI: InChI=1/C45H80O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1
(3)InChIKey: XHRPOTDGOASDJS-XNTGVSEIBS
(4)Std. InChI: InChI=1S/C45H80O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1
(5)Std. InChIKey: XHRPOTDGOASDJS-XNTGVSEISA-N