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Atovaquone-d5

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For Research Use Only | Not For Clinical Use
CATAPS1329792633
CAS1329792-63-3
Structure
SynonymsBW-566C-80-d5,2-[trans-4-(4-Chlorophenyl)cyclohexyl-d5-]-3-hydroxy-1,4-naphthalenedione, Wellvone-d5, BW-566C-d5, 566C80-d5, Mepron-d5
IUPAC Name2-[4-(4-chlorophenyl)-1,2,2,6,6-pentadeuterio-cyclohexyl]-3-hydroxy-naphthalene-1,4-dione
Molecular Weight371.87
Molecular FormulaC22D5H14ClO3
Canonical SMILES[2H]C1([2H])CC(CC([2H])([2H])C1([2H])C2=C(O)C(=O)c3ccccc3C2=O)c4ccc(Cl)cc4
InChIInChI=1S/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,26H,5-8H2/t13?,15-/i7D2,8D2,15D
Accurate Mass371.1337
FormatNeat
SubcategoryStable isotope labelled compounds, Quinones
TypeStable Isotope Labelled
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