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Omeprazole Sulfone N-Oxide-[13C,d3]

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General Information
Catalog: BLP-012920
Molecular Formula: C16[13C]H16D3N3O5S
Molecular Weight: 381.43
Chemical Structure
Omeprazole Sulfone N-Oxide-[13C,d3]
Description Omeprazole Sulfone N-Oxide-[13C,d3] is the labelled analogue of Omeprazole Sulfone N-Oxide, which is a metabolite of Omeprazole. Omeprazole is a proton pump inhibitor used in the treatment of dyspepsia.
Synonyms Omeprazole-13C,D3 Sulfone N-Oxide; 6-Methoxy-2-[[(4-methoxy-3,5-dimethyl-1-oxido-2-pyridinyl)methyl]sulfonyl]-1H-benzimidazole-13C,d3; 2-[[(3,5-Dimethyl-4-methoxy-1-oxido-2-pyridyl)methyl]sulfonyl]-5-methoxybenzimidazole-13C,d3; Omeprazole EP Impurity I-13C,d3
IUPAC Name 2-[(4-methoxy-3,5-dimethyl-1-oxidopyridin-1-ium-2-yl)methylsulfonyl]-6-(trideuterio(1-13C)methoxy)-1H-benzimidazole
Related CAS 158812-85-2 (unlabelled)
Canonical SMILES CC1=C[N+](=C(C(=C1OC)C)CS(=O)(=O)C2=NC3=C(N2)C=C(C=C3)OC)[O-]
InChI InChI=1S/C17H19N3O5S/c1-10-8-20(21)15(11(2)16(10)25-4)9-26(22,23)17-18-13-6-5-12(24-3)7-14(13)19-17/h5-8H,9H2,1-4H3,(H,18,19)/i3+1D3
InChI Key ZBGMHRIYIGAEGJ-LBDFIVMYSA-N
Purity ≥99% by HPLC; 99% atom 13C; 99% atom D
Solubility Soluble in DMSO (Slightly), Methanol (Slightly, Heated)
Appearance White Solid
Storage Store at 2-8°C
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