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Decoquinate D5

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For Research Use Only | Not For Clinical Use
CATAPS1453100612
CAS1453100-61-2
Structure
SynonymsDecoquinate D5, Ethyl 6-decoxy-4-hydroxy-7-(1,1,2,2,2-pentadeuterioethoxy)quinoline-3-carboxylate,Decoquinate D5 (7-ethoxy D5)
IUPAC Nameethyl 6-decoxy-4-hydroxy-7-(1,1,2,2,2-pentadeuterioethoxy)quinoline-3-carboxylate
Molecular Weight422.57
Molecular FormulaC242H5H30NO5
Canonical SMILES[2H]C([2H])([2H])C([2H])([2H])Oc1cc2ncc(C(=O)OCC)c(O)c2cc1OCCCCCCCCCC
InChIInChI=1S/C24H35NO5/c1-4-7-8-9-10-11-12-13-14-30-21-15-18-20(16-22(21)28-5-2)25-17-19(23(18)26)24(27)29-6-3/h15-17H,4-14H2,1-3H3,(H,25,26)/i2D3,5D2
Accurate Mass422.2829
FormatNeat
Product TypeStable Isotope Labelled
ShippingRoom Temperature
Storage Conditions+20°C
SubcategoryStable isotope labelled compounds, Pharmaceutical and veterinary compounds and metabolites
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