STIGMASTANOL

The Stigmastan-3-ol, (3β)- is an organic compound with the formula C₂₉H₅₂O. The IUPAC name of this chemical is 17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol. With the CAS registry number 19466-47-8, it is also named as (3β)-Stigmastan-3-ol. The product's categories are Biochemistry; Hydroxysteroids; Steroids.

Physical properties about Stigmastan-3-ol, (3β)- are: (1)ACD/LogP: 11.10; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 11.1; (4)ACD/LogD (pH 7.4): 11.1; (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: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 7; (12)Index of Refraction: 1.501; (13)Molar Refractivity: 129.57 cm³; (14)Molar Volume: 439.5 cm³; (15)Polarizability: 51.36×10^-24cm³; (16)Surface Tension: 34.4 dyne/cm; (17)Density: 0.948 g/cm³; (18)Flash Point: 197.1 °C; (19)Enthalpy of Vaporization: 84.71 kJ/mol; (20)Boiling Point: 471.9 °C at 760 mmHg; (21)Vapour Pressure: 6.88E-11 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing and avoid contact with skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O[C@H]4CC[C@]3(C(CC[C@H]2[C@@H]1CC[C@@H]([C@@]1(C)CC[C@@H]23)[C@H](C)CC[C@@H](CC)C(C)C)C4)C
(2)InChI: InChI=1/C29H52O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h19-27,30H,7-18H2,1-6H3/t20-,21-,22?,23+,24+,25-,26+,27+,28+,29-/m1/s1
(3)InChIKey: LGJMUZUPVCAVPU-KZXGMYDKBK
(4)Std. InChI: InChI=1S/C29H52O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h19-27,30H,7-18H2,1-6H3/t20-,21-,22?,23+,24+,25-,26+,27+,28+,29-/m1/s1
(5)Std. InChIKey: LGJMUZUPVCAVPU-KZXGMYDKSA-N