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Trimebutine-[d5]

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Trimebutine-[d5]

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General Information
Catalog: BLP-007525
CAS: 1189928-38-8
Molecular Formula: C22H24D5NO5
Molecular Weight: 392.50

Chemical Structure

Description	Labelled Trimebutine. Trimebutine is an agonist of peripheral mu, kappa and delta opiate receptors, used as a spasmolytic agent for the treatment of both acute and chronic abdominal pain.
Synonyms	3,4,5-Trimethoxybenzoic Acid 2-(Dimethylamino)-2-phenylbutyl-d5 Ester
IUPAC Name	[3,3,4,4,4-pentadeuterio-2-(dimethylamino)-2-phenylbutyl] 3,4,5-trimethoxybenzoate
Related CAS	39133-31-8 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C([2H])([2H])C(COC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)N(C)C
Canonical SMILES	CCC(COC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)N(C)C
InChI	InChI=1S/C22H29NO5/c1-7-22(23(2)3,17-11-9-8-10-12-17)15-28-21(24)16-13-18(25-4)20(27-6)19(14-16)26-5/h8-14H,7,15H2,1-6H3/i1D3,7D2
InChI Key	LORDFXWUHHSAQU-WRMAMSRYSA-N
Melting Point	122-124°C
Purity	>98%
Solubility	Soluble in Chloroform
Appearance	White Solid
Storage	Store at -20°C