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3-Hydroxy Tolperisone-[d10] maleate

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General Information
Catalog: BLP-013830
CAS: 1346606-23-2
Molecular Formula: C20H17D10NO6
Molecular Weight: 387.49

Chemical Structure

Description	3-Hydroxy Tolperisone-[d10] maleate is the labelled analogue of 3-Hydroxy Tolperisone maleate, which is a metabolite of Tolperisone.
Synonyms	3-Hydroxy Tolperisone-d10 maleate; 1-(3-Hydroxy-4-methylphenyl)-2-methyl-3-(1-piperidinyl-d10)-1-propanone (2Z)-2-Butenedioate
IUPAC Name	(Z)-but-2-enedioic acid;3-(2,2,3,3,4,4,5,5,6,6-decadeuteriopiperidin-1-yl)-1-(3-hydroxy-4-methylphenyl)-2-methylpropan-1-one
Related CAS	283585-02-4 (unlabelled) 59303-39-8 (unlabelled free base)
Canonical SMILES	CC1=C(C=C(C=C1)C(=O)C(C)CN2CCCCC2)O.C(=CC(=O)O)C(=O)O
InChI	InChI=1S/C16H23NO2.C4H4O4/c1-12-6-7-14(10-15(12)18)16(19)13(2)11-17-8-4-3-5-9-17;5-3(6)1-2-4(7)8/h6-7,10,13,18H,3-5,8-9,11H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/i3D2,4D2,5D2,8D2,9D2;
InChI Key	LBIPWJFYYZEVQC-STVQHHEZSA-N
Purity	99% by HPLC
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	Pale Beige Solid
Storage	Store at 2-8°C