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Fexofenadine-d10 Hydrochloride

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For Research Use Only | Not For Clinical Use
CATAPS1215821445
CAS1215821-44-5
SynonymsFexofenadine (diphenyl D10) hydrochloride,4-[1-Hydroxy-4-[4-(hydroxydi(phenyl-d5)methyl)-1-piperidinyl]butyl]-α,α-di(methyl-d3)-benzeneacetic acid hydrochloride, Fexofenadine-d10 hydrochloride
IUPAC Name2-[4-[1-hydroxy-4-[4-[hydroxy-bis(2,3,4,5,6-pentadeuteriophenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid;hydrochloride
Molecular Weight548.18
Molecular FormulaC322H10H29NO4.ClH
Canonical SMILESCl.[2H]c1c([2H])c([2H])c(c([2H])c1[2H])C(O)(C2CCN(CCCC(O)c3ccc(cc3)C(C)(C)C(=O)O)CC2)c4c([2H])c([2H])c([2H])c([2H])c4[2H]
InChIInChI=1S/C32H39NO4.ClH/c1-31(2,30(35)36)25-17-15-24(16-18-25)29(34)14-9-21-33-22-19-28(20-23-33)32(37,26-10-5-3-6-11-26)27-12-7-4-8-13-27;/h3-8,10-13,15-18,28-29,34,37H,9,14,19-23H2,1-2H3,(H,35,36);1H/i3D,4D,5D,6D,7D,8D,10D,11D,12D,13D;
Accurate Mass547.3274
FormatNeat
SubcategoryEnzyme inhibitors, Stable isotope labelled compounds
TypeStable Isotope Labelled
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