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N-Desethyl Milnacipran-[d5]

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General Information
Catalog: BLP-012892
CAS: 1217609-30-7
Molecular Formula: C13H13D5N2O
Molecular Weight: 223.33

Chemical Structure

Description	N-Desethyl Milnacipran-[d5] is the labelled analogue of N-Desethyl Milnacipran, which is a metabolite of Milnacipran.
Synonyms	N-Desethyl Milnacipran D5; (1R,2S)-rel-2-(Aminomethyl)-N-(ethyl-d5)-1-phenylcyclopropanecarboxamide; cis-2-(Aminomethyl)-N-(ethy-d5)-1-phenylcyclopropanecarboxamide; N-Deethylated Milnacipran-d5
IUPAC Name	(1R,2S)-2-(aminomethyl)-N-(1,1,2,2,2-pentadeuterioethyl)-1-phenylcyclopropane-1-carboxamide
Related CAS	105310-07-4 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C([2H])([2H])NC(=O)[C@@]1(C[C@@H]1CN)C2=CC=CC=C2
Canonical SMILES	CCNC(=O)C1(CC1CN)C2=CC=CC=C2
InChI	InChI=1S/C13H18N2O/c1-2-15-12(16)13(8-11(13)9-14)10-6-4-3-5-7-10/h3-7,11H,2,8-9,14H2,1H3,(H,15,16)/t11-,13+/m1/s1/i1D3,2D2
InChI Key	UVKUMJGXPDEXSQ-WXLZTCJXSA-N
Purity	>95%
Solubility	Soluble in DMSO, Methanol
Appearance	Pale Yellow Thick Oily Matter
Storage	Store at -20°C