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Hydroxy Cerivastatin-[d3] Sodium Salt

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General Information
Catalog: BLP-005916
Molecular Formula: C26H30D3FNNaO6
Molecular Weight: 500.55

Chemical Structure

Description	Hydroxy Cerivastatin-[d3] Sodium Salt is the labelled derivative of Hydroxy Cerivastatin, a competitive inhibitor of HMG-CoA reductase.
Synonyms	(3R,5S,6E)-7-[4-(4-Fluorophenyl)-6-[(1S)-2-hydroxy-1-methylethyl]-5-[(methoxy-d3)-methyl]-2-(1-methylethyl)-3-pyridinyl]-3,5-dihydroxy-6-heptenoic Acid Sodium Salt; M-23 Metabolite-d3
IUPAC Name	sodium;(E,3R,5S)-7-[4-(4-fluorophenyl)-6-[(2S)-1-hydroxypropan-2-yl]-2-propan-2-yl-5-(trideuteriomethoxymethyl)pyridin-3-yl]-3,5-dihydroxyhept-6-enoate
Related CAS	189060-31-9 (unlabelled)
Canonical SMILES	CC(C)C1=C(C(=C(C(=N1)C(C)CO)COC)C2=CC=C(C=C2)F)C=CC(CC(CC(=O)[O-])O)O.[Na+]
InChI	InChI=1S/C26H34FNO6.Na/c1-15(2)25-21(10-9-19(30)11-20(31)12-23(32)33)24(17-5-7-18(27)8-6-17)22(14-34-4)26(28-25)16(3)13-29;/h5-10,15-16,19-20,29-31H,11-14H2,1-4H3,(H,32,33);/q;+1/p-1/b10-9+;/t16-,19-,20-;/m1./s1/i4D3;
InChI Key	KXWIMFNOEPAPDJ-KYRYBIALSA-M
Melting Point	99-104°C
Purity	95% by CP; 95% atom D
Solubility	Slightly soluble in Methanol, Water
Appearance	White to Pale Yellow Solid
Storage	Store at -20°C