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AO-774/41465633 is available in 359 mg

Compound details
Formula:		C26 H40 O6
Weight:		448.6
Chiral info:		Compound is marked as Chiral
Name:		Cholic acid, derivative of
SMILES:		[H]C12(CC(O)CCC1(C)C3([H])(CC(=O)C4(C)(C(CCC4([H])(C3([H])(C(C2)OC(C)=O)))C(C)CCC(O)=O)))
InChI^TM:		InChI=1S/C26H40O6/c1-14(5-8-23(30)31)18-6-7-19-24-20(13-22(29)26(18,19)4)25(3)10-9-17(28)11-16(25)12-21(24)32-15(2)27/h14,16-21,24,28H,5-13H2,1-4H3,(H,30,31)
InChIKey^TM:		XQVPUYVJDCWVQR-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		18600 mg/Kg
Chronic LOAEL:		637 mg/Kg
Developmental Toxicity Potential:		0.9

Chemical properties calculations
LogP:	Could not be calculated	H-acceptors: 6
LogS:	Could not be calculated	H-donors: 2
tPSA:	100.9 Å²	Rotatable bonds: 6

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Disclaimer: Predicted physical and biological properties, such as toxicity, mentioned on this website are indicative only and may not be relied upon in any way. Liability for damages of any kind resulting from reliance on these properties is expressly rejected.