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Vorapaxar-[d5]

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General Information
Catalog: BLP-008184
Molecular Formula: C29H28D5FN2O4
Molecular Weight: 497.61

Chemical Structure

Description	One of the isotopic labelled form of Vorapaxar, which has been found to be an antiplatelet agent and could be potentially effective against atherothrombosis.
Synonyms	(1,1,2,2,2-D5)ethyl N-[(1R,3aR,4aR,6R,8aR,9S,9aS)-9-[(E)-2-[5-(3-fluorophenyl)pyridin-2-yl]ethenyl]-1-methyl-3-oxo-dodecahydronaphtho[2,3-c]furan-6-yl]carbamate
IUPAC Name	1,1,2,2,2-pentadeuterioethyl N-[(1R,3aR,4aR,6R,8aR,9S,9aS)-9-[(E)-2-[5-(3-fluorophenyl)pyridin-2-yl]ethenyl]-1-methyl-3-oxo-3a,4,4a,5,6,7,8,8a,9,9a-decahydro-1H-benzo[f][2]benzofuran-6-yl]carbamate
Related CAS	618385-01-6 (unlabelled) 705260-08-8 (unlabelled sulfate)
Canonical SMILES	CCOC(=O)NC1CCC2C(C1)CC3C(C2C=CC4=NC=C(C=C4)C5=CC(=CC=C5)F)C(OC3=O)C
InChI	InChI=1S/C29H33FN2O4/c1-3-35-29(34)32-23-10-11-24-20(14-23)15-26-27(17(2)36-28(26)33)25(24)12-9-22-8-7-19(16-31-22)18-5-4-6-21(30)13-18/h4-9,12-13,16-17,20,23-27H,3,10-11,14-15H2,1-2H3,(H,32,34)/b12-9+/t17-,20+,23-,24-,25+,26-,27+/m1/s1/i1D3,3D2
InChI Key	ZBGXUVOIWDMMJE-MRDNJKQJSA-N
Purity	>98%