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AE-842/20720046 is available in 161 mg

Compound details
Formula:		C28 H48 O3
Weight:		432.68
Chiral info:		Compound is marked as Chiral
Name:		Guggulsterol IV, derivative of
SMILES:		COC1CCC2(C)(C3CCC4(C)(C(CCC4(C3(CC(=O)C2(O)(C1))))C(C)CCCC(C)C))
InChI^TM:		InChI=1S/C28H48O3/c1-18(2)8-7-9-19(3)22-10-11-23-21-16-25(29)28(30)17-20(31-6)12-15-27(28,5)24(21)13-14-26(22,23)4/h18-24,30H,7-17H2,1-6H3
InChIKey^TM:		MCXULCLKYCWUMP-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		164 mg/Kg
Chronic LOAEL:		51.1 mg/Kg
Developmental Toxicity Potential:		0.05

Chemical properties calculations
LogP:	7.59	H-acceptors: 3
LogS:	-8.33	H-donors: 1
tPSA:	46.53 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.