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Rotigotine-[d7] Hydrochloride

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Rotigotine-[d7] Hydrochloride

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General Information
Catalog: BLP-004165
CAS: 2070009-57-1
Molecular Formula: C19H18NOSD7·HCl
Molecular Weight: 358.98

Chemical Structure

Description	Rotigotine-[d7] Hydrochloride is the labelled hydrochloride salt form of Rotigotine which is a dopamine D2 and D3 receptor agonist and has been shown to be effective in the treatment of Parkinson's disease. IC50 values of 13 nM and 0.71 nM for D2 and D3 receptor respectively.
IUPAC Name	(6S)-6-[1,1,2,2,3,3,3-heptadeuteriopropyl(2-thiophen-2-ylethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol;hydrochloride
Related CAS	125572-93-2 (unlabelled) 1189657-75-7 (free amine)
Canonical SMILES	CCCN(CCC1=CC=CS1)C2CCC3=C(C2)C=CC=C3O.Cl
InChI	InChI=1S/C19H25NOS.ClH/c1-2-11-20(12-10-17-6-4-13-22-17)16-8-9-18-15(14-16)5-3-7-19(18)21;/h3-7,13,16,21H,2,8-12,14H2,1H3;1H/t16-;/m0./s1/i1D3,2D2,11D2;
InChI Key	CEXBONHIOKGWNU-JRJHKODKSA-N
Purity	> 95%
Storage	Store at 2-8°C