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5'-Hydroxyomeprazole-[13C,d2] sodium salt

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General Information
Catalog: BLP-002997
Molecular Formula: C16[13C]H16D2N3O4S.Na
Molecular Weight: 386.40

Chemical Structure

Description	5'-Hydroxyomeprazole-[13C,d2] sodium salt is the labelled analogue of 5'-Hydroxyomeprazole sodium salt, which is the main metabolite of Omeprazole.
Synonyms	5'-Hydroxyomeprazole-13C,D2 sodium
IUPAC Name	sodium;dideuterio-[4-methoxy-6-[(6-methoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-5-methylpyridin-3-yl](1-13C)methanolate
Related CAS	1215629-45-0 (unlabelled)
Canonical SMILES	CC1=C(C(=CN=C1CS(=O)C2=NC3=C(N2)C=C(C=C3)OC)C[O-])OC.[Na+]
InChI	InChI=1S/C17H18N3O4S.Na/c1-10-15(18-7-11(8-21)16(10)24-3)9-25(22)17-19-13-5-4-12(23-2)6-14(13)20-17;/h4-7H,8-9H2,1-3H3,(H,19,20);/q-1;+1/i8+1D2;
InChI Key	VZCHYRCJHZQAPP-BUXAWKLFSA-N