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Omeprazole Sulfone-[13C,d3]

General Information
Catalog: BLP-012923
CAS: 1261393-28-5
Molecular Formula: C16[13C]H16D3N3O4S
Molecular Weight: 365.43
Chemical Structure
Omeprazole Sulfone-[13C,d3]
Description Omeprazole Sulfone-[13C,d3] is the labelled analogue of Omeprazole Sulfone, which is a metabolite of Omeprazole. Omeprazole is a proton pump inhibitor used in the treatment of dyspepsia.
Synonyms Omeprazole-13C,D3 Sulfone; 6-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfonyl]-1H-benzimidazole-13C,d3; 2-[[(3,5-Dimethyl-4-methoxy-2-pyridyl)methyl]sulfonyl]-5-methoxybenzimidazole-13C,d3
IUPAC Name 2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfonyl]-6-(trideuterio(1-13C)methoxy)-1H-benzimidazole
Related CAS 88546-55-8 (unlabelled)
Canonical SMILES CC1=CN=C(C(=C1OC)C)CS(=O)(=O)C2=NC3=C(N2)C=C(C=C3)OC
InChI InChI=1S/C17H19N3O4S/c1-10-8-18-15(11(2)16(10)24-4)9-25(21,22)17-19-13-6-5-12(23-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)/i3+1D3
InChI Key IXEQEYRTSRFZEO-LBDFIVMYSA-N
Purity ≥99% by HPLC; 99% atom 13C; 99% atom D
Solubility Soluble in Chloroform (Slightly), DMSO, Methanol
Appearance Off-white Solid
Storage Store at -20°C under inert atmosphere

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