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trans-3'-Hydroxy Cotinine-[d3]

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General Information
Catalog: BLP-009623
CAS: 159956-78-2
Molecular Formula: C10H9N2O2D3
Molecular Weight: 195.23

Chemical Structure

Description	trans-3'-Hydroxy Cotinine-[d3] is a labelled impurity of Cotinine. Cotinine, a metabolite of nicotine, is potentially to be a therapy of mental diseases, including depression, PTSD, schizophrenia, Alzheimer's disease and Parkinson's disease.
Synonyms	trans-3-Hydroxy-1-(methyl-d3)-5-(3-pyridinyl)-2-pyrrolidinone
IUPAC Name	(3R,5S)-3-hydroxy-5-pyridin-3-yl-1-(trideuteriomethyl)pyrrolidin-2-one
Related CAS	34834-67-8 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])N1[C@@H](C[C@H](C1=O)O)C2=CN=CC=C2
Canonical SMILES	CN1C(CC(C1=O)O)C2=CN=CC=C2
InChI	InChI=1S/C10H12N2O2/c1-12-8(5-9(13)10(12)14)7-3-2-4-11-6-7/h2-4,6,8-9,13H,5H2,1H3/t8-,9+/m0/s1/i1D3
InChI Key	XOKCJXZZNAUIQN-IRPRQUBLSA-N
Melting Point	94-97°C
Purity	> 95%
Appearance	Off-White Solid