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N-Acetyl-S-(3-carboxy-2-propyl)-L-cysteine-[d3] Disodium Salt

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General Information
Catalog: BLP-006344
CAS: 1356933-73-7
Molecular Formula: C9H10D3NNa2O5S
Molecular Weight: 296.27

Chemical Structure

Synonyms	N-Acetyl-S-(3-carboxy-2-propyl)-L-cysteine-d3 Disodium Salt; 3-[[(2R)-2-[(Acetyl-d3)amino]-2-carboxyethyl]thio]butanoic Acid Disodium Salt; 2-Carboxy-1-methylethylmercapturic Acid-d3 Disodium Salt
IUPAC Name	disodium;3-[(2R)-2-carboxylato-2-[(2,2,2-trideuterioacetyl)amino]ethyl]sulfanylbutanoate
Related CAS	1041285-62-4 (unlabelled) 33164-65-7 (unlabelled free acid)
Isomeric SMILES	[2H]C([2H])([2H])C(=O)N[C@@H](CSC(C)CC(=O)[O-])C(=O)[O-].[Na+].[Na+]
Canonical SMILES	CC(CC(=O)[O-])SCC(C(=O)[O-])NC(=O)C.[Na+].[Na+]
InChI	InChI=1S/C9H15NO5S.2Na/c1-5(3-8(12)13)16-4-7(9(14)15)10-6(2)11;;/h5,7H,3-4H2,1-2H3,(H,10,11)(H,12,13)(H,14,15);;/q;2*+1/p-2/t5?,7-;;/m0../s1/i2D3;;
InChI Key	MUCIEDHPXAQZRB-YRXXMFLKSA-L
Melting Point	>270°C (dec.)
Purity	96%; ≥97% atom D
Solubility	Slightly soluble in Water
Appearance	White Solid
Storage	Store at -20°C