Cholest-4-en-3-one,oxime (22033-87-0)

The Olesoxime with the cas number 22033-87-0 is also called N-Hydroxycholest-4-en-3-imine. The systematic name is (8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one oxime. Its molecular formula is C₂₇H₄₅NO. This chemical should be stored at −20°C. The Biological Activity: (1)Neuroprotective and neuroregenerative compound; (2)Rescues motor neurons from axotomy-induced cell death and promotes nerve regeneration following sciatic nerve crush in vivo; (3)Binds directly to two components of the mitochondrial permeability pore, the voltage-dependent anion channel (VDAC) and translocator protein.

The properties of the chemical are: (1)ACD/LogP: 9.85; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 9.85; (4)ACD/LogD (pH 7.4): 9.85; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 5408799.5; (8)ACD/KOC (pH 7.4): 5408746; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 32.59 Å²; (13)Index of Refraction: 1.583; (14)Molar Refractivity: 120.83 cm³; (15)Molar Volume: 361.3 cm³; (16)Polarizability: 47.9×10^-24cm³; (17)Surface Tension: 37.6 dyne/cm; (18)Enthalpy of Vaporization: 89.87 kJ/mol; (19)Vapour Pressure: 1.56×10^-12 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=NO)CC[C@]34C)C
(2)InChI: InChI=1/C27H45NO/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28-29)13-15-26(20,4)25(22)14-16-27(23,24)5/h17-19,22-25,29H,6-16H2,1-5H3/t19-,22+,23-,24+,25+,26+,27-/m1/s1
(3)InChIKey: QNTASHOAVRSLMD-GYKMGIIDBY