Artemisinin-[d3]

Category	Hepatitis C Virus (HCV)
CAS	176652-07-6
Description	Artemisinin-[d3] is the labelled analogue of Artemisinin. Artemisinin is a natural product originally isolated from plants of the genus Artemisia. It effectively kills malarial parasites of the genus Plasmodium. It is usually used in combination therapy for the treatment of malaria. Artemisinin is also used against a wide range of trematodes, including Schistosoma.

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Synonyms	Artemisinin D3; (3R,5aS,6R,8aS,9R,12S,12aR)-Octahydro-3,6-dimethyl-9-(methyl-d3)-3,12-epox-12H-pyrano[4,3-j]-1,2-benzodioxepin-10(3H)-one; Artemisine-d3; Arteannuin-d3; Huanghuahaosu-d3; QHS-d3
IUPAC Name	(1R,4S,5R,8S,9R,12S,13R)-1,5-dimethyl-9-(trideuteriomethyl)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-one
Molecular Weight	285.36
Molecular Formula	C15H19D3O5
Canonical SMILES	CC1CCC2C(C(=O)OC3C24C1CCC(O3)(OO4)C)C
InChI	InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14-,15-/m1/s1/i2D3
InChIKey	BLUAFEHZUWYNDE-OGUHANSASA-N
Purity	98% by HPLC; ≥99% atom D
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	White Solid
Storage	Store at -20°C
Complexity	452
Exact Mass	285.16600
In Vitro	Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and Metabolic profiles of drugs.
PSA	53.99000
Target	Parasite; HCV; Ferroptosis; Akt
Vapor Pressure	0mmHg at 25°C
XLogP3-AA	2.8