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Clavulanic Acid Methyl-[d3] Ester

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General Information
Catalog: BLP-014842
CAS: 1821757-56-5
Molecular Formula: C9H8D3NO5
Molecular Weight: 216.21

Chemical Structure

Description	Clavulanic Acid Methyl-[d3] Ester is the labelled form of Clavulanic Acid Methyl Ester. It is a substituted Clavulanic acid as a b-lactamase inhibitor.
Synonyms	(2R,3Z,5R)-3-(2-Hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid Methyl-d3 Ester; [2R-(2α,3Z,5α)]-3-(2-Hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic Acid Methyl-d3 Ester; Methyl-d3 Clavulanate; Clavulanic Acid Methyl-d3 Ester
IUPAC Name	trideuteriomethyl (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate
Related CAS	57943-82-5 (unlabelled)
Canonical SMILES	COC(=O)C1C(=CCO)OC2N1C(=O)C2
InChI	InChI=1S/C9H11NO5/c1-14-9(13)8-5(2-3-11)15-7-4-6(12)10(7)8/h2,7-8,11H,3-4H2,1H3/b5-2-/t7-,8-/m1/s1/i1D3
InChI Key	HTABQNQMGKGBDT-QEYUTSQOSA-N
Melting Point	N/A
Purity	96.3%; 99.7% atom D
Solubility	DMSO (Slightly) ,Methanol (Slightly)
Appearance	Pale Yellow to Light Yellow Thick Oil
Storage	-20°C